3-hydroxy-N-(quinolin-3-ylmethyl)benzamide

C17H14N2O2 — CID 110472397

IUPAC3-hydroxy-N-(quinolin-3-ylmethyl)benzamide
SMILESO=C(NCc1cnc2ccccc2c1)c1cccc(O)c1
InChIInChI=1S/C17H14N2O2/c20-15-6-3-5-14(9-15)17(21)19-11-12-8-13-4-1-2-7-16(13)18-10-12/h1-10,20H,11H2,(H,19,21)
InChIKeyPBMOIWXMNKMEQZ-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.87
Rot. Bonds3

About 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide

3-hydroxy-N-(quinolin-3-ylmethyl)benzamide (PubChem CID 110472397) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-hydroxy-N-(quinolin-3-ylmethyl)benzamide
PubChem CID110472397
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name3-hydroxy-N-(quinolin-3-ylmethyl)benzamide
SMILESO=C(NCc1cnc2ccccc2c1)c1cccc(O)c1
InChIInChI=1S/C17H14N2O2/c20-15-6-3-5-14(9-15)17(21)19-11-12-8-13-4-1-2-7-16(13)18-10-12/h1-10,20H,11H2,(H,19,21)
InChIKeyPBMOIWXMNKMEQZ-UHFFFAOYSA-N
XLogP2.87
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethyl-N-(quinolin-3-ylmethyl)quinoxaline-6-carboxamide
CID 110745511
5-[[(3-hydroxybenzoyl)amino]methyl]pyridine-2-carboxylic acid
CID 81099820
2-ethyl-N-(quinolin-3-ylmethyl)butanamide
CID 110733756
2-(3-methylphenyl)-N-(quinolin-3-ylmethyl)acetamide
CID 110733803
2-methyl-N-(quinolin-3-ylmethyl)propanamide
CID 110733747
2-(2-fluorophenyl)-N-(quinolin-3-ylmethyl)acetamide
CID 110733805
N-[(8-sulfanylquinolin-3-yl)methyl]benzamide
CID 159965850
N-[[4-(diethylamino)phenyl]methyl]-3-quinolin-3-ylbenzamide
CID 46389962
(Z)-2-[[4-[(3-hydroxyphenyl)methylcarbamoyl]-2-methylbenzoyl]amino]-3-quinolin-3-ylprop-2-enoic acid
CID 23560661
2-[[4-[(3-hydroxyphenyl)methylcarbamoyl]-2-methylbenzoyl]amino]-3-quinolin-3-ylprop-2-enoic acid
CID 70028015
N-[(2-chlorophenyl)methyl]-3-quinolin-3-ylbenzamide
CID 46389949
N-(quinolin-3-ylmethyl)ethanamine
CID 16640553

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide?
The IUPAC name of 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide (CID 110472397) is 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide.
What is the SMILES notation for 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide?
The canonical SMILES for 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide is O=C(NCc1cnc2ccccc2c1)c1cccc(O)c1.
What is the InChIKey of 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide?
The InChIKey is PBMOIWXMNKMEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c20-15-6-3-5-14(9-15)17(21)19-11-12-8-13-4-1-2-7-16(13)18-10-12/h1-10,20H,11H2,(H,19,21).
What are the key properties of 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide?
3-hydroxy-N-(quinolin-3-ylmethyl)benzamide has a molecular weight of 278.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(quinolin-3-ylmethyl)benzamide is sourced from PubChem (CID 110472397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).