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10000 51 8 3-Hydroxy-N-(2-methoxyethyl)naphthalene-2-carboxamide | Chemryt

Chemical : 3-Hydroxy-N-(2-methoxyethyl)naphthalene-2-carboxamide

Casrn : 10000-51-8

MolName : 3-Hydroxy-N-(2-methoxyethyl)naphthalene-2-carboxamide

MolecularFormula : C14H15NO3

Smiles : COCCNC(c1cc2ccccc2cc1O)=O

InChI : InChI=1S/C14H15NO3/c1-18-7-6-15-14(17)12-8-10-4-2-3-5-11(10)9-13(12)16/h2-5,8-9,16H,6-7H2,1H3,(H,15,17)

InChIK : XMKXSYWXZHEGOT-UHFFFAOYSA-N

CanonicalSyTyLFy : 9ed376c27683b139

TotalMolweight : 245.277

Molweight : 245.277

MonoisotopicMass : 245.105194

CLogP : 1.8546

CLogS : -2.852

H Acceptors : 4

H Donors : 2

TotalSurfaceArea : 193.2

Relative PSA : 0.24638

PolarSurfaceArea : 58.56

Druglikeness : 0.10503

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Shape Index : 0.66667

Molecula Flexibility : 0.47565

Molecular Complexity : 0.69754

Fragments : 1

Non HAtoms : 18

NonCHAtoms : 4

Electronegative Atoms : 4

Rotatable Bond : 4

Rings Closures : 2

Small Rings : 2

Aromatic Rings : 2

Aromatic Atoms : 10

Sp3Atoms : 5

Amides : 1

CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness
100007-67-8highnonelowC5H7OClF2156.559-12.702
100010-21-7nonenonenoneC14H21NO219.327-4.2999
1000018-25-6nonenonenoneC13H24N2O6S336.408-32.405
100-48-1nonenonenoneC6H4N2104.112-6.0498
100-10-7nonehighhighC9H11NO149.192-1.8715
1000-40-4highnonelowC10H24S2Sn327.143-7.0269
100-61-8highnonenoneC7H9N107.155-0.23765
1000025-92-2nonenonenoneC20H16N2O2316.359-6.3825
10000-20-1nonelowhighC12H32N2Si2260.572-64.51
1000018-51-8nonenonenoneC10H10N2O2S2254.3331.3137
100-75-4highhighhighC5H10N2O114.147-0.86877
100004-94-2nonenonenoneC13H11NO2213.235-1.5864
1000-57-3highnonelowC6H16SSn238.969-7.4261
100-87-8nonenonenoneC7H8O3S172.204-10.732
1000-90-4nonenonenoneZn.C4H7OS2.C4H7OS2135.231-2.7683
100033-59-8nonenonenoneC8H16N2140.2290.9406
1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077
1000018-70-1nonenonenoneC15H18N2O6322.316-6.5762
1000-44-8highhighlowC7H7Cl126.586-8.5908
1000018-48-3nonenonenoneC12H15NO4S269.321.5148
100-39-0highhighnoneC7H7Br171.037-7.8241
10003-95-9nonenonenoneC10H18N2O17P4562.146-25.989
100-06-1nonenonenoneC9H10O2150.176-1.6836
1000339-55-8nonenonenoneC9H7O2F3204.147-12.197
100008-84-2nonenonenoneC22H14N2O2338.3653.1859
1000339-33-2nonenonenoneC10H11NClF199.6550.76
100008-89-7nonenonenoneC11H10N4O3246.225-1.8465
100-33-4nonenonenoneC19H24N4O2340.426-7.2784
1000068-24-5nonenonelowC13H15NO4BCl295.529-44.638
100-44-7highhighnoneC7H7Cl126.586-2.365
10001-08-8nonenonehighC11H22N2O198.309-3.1037
100004-80-6nonenonenoneC13H11NO3229.234-1.3547
10001-51-1nonenonenoneC9H18N2O170.2555.9677
100-82-3nonenonenoneC7H8NF125.146-3.4112
100008-36-4nonenonenoneC17H22O2258.36-5.6379
100-97-0highhighhighC6H12N4140.1891.5849
100-96-9highnonenoneC7H10N2O138.169-1.7412
100-20-9highnonelowC8H4O2Cl2203.024-10.706
100-29-8nonenonenoneC8H9NO3167.163-8.928
1000-58-4highhighhighC4H8Cl4Si226.006-54.611
100011-01-6nonenonenoneC9H18O2158.24-2.3462
100-04-9nonehighnoneCl.C8H10N3148.188-2.0275
1000018-26-7nonenonenoneC16H23NO3277.363-15.052
100-83-4highnonelowC7H6O2122.123-4.1407
100010-02-4nonenonenoneC14H23NO221.343-6.1109
100-15-2nonehighnoneC7H8N2O2152.153-5.7806
100-91-4nonenonehighC17H25NO3291.393.3475
10001-52-2highhighnoneC11H10N6O3S306.3056.7202
100031-92-3nonenonehighC10H30OSi4278.691-53.619
1000-67-5nonenonehighC4H9O4S.Na153.177-10.412
1000018-71-2nonenonehighC14H19N3O4293.322-2.5213
100003-85-8highhighnoneC13H8N2OCl2S311.1921.0858
100-09-4nonenonenoneC8H8O3152.149-1.597
100005-68-3nonenonenoneC13H12O4232.234-4.9451
100008-90-0nonenonenoneC12H11N3O3245.237-1.9187
100-41-4highhighhighC8H10106.167-2.68
10-35-5nonenonenoneC4H6O2BrF184.992-23.473
100-77-6nonenonenoneC6H4N2Cl.Cl139.565-4.1248
10-18-2004nonenonenoneC6H8OS2160.261-3.1913
1000068-23-4nonelownoneC14H18NO5B291.11-44.603