N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide

C15H14ClNO3 — CID 11748334

IUPACN-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCc2ccc(Cl)cc2)c1O
InChIInChI=1S/C15H14ClNO3/c1-20-13-4-2-3-12(14(13)18)15(19)17-9-10-5-7-11(16)8-6-10/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyCLHKDIZPHVXESB-UHFFFAOYSA-N
MW291.73 g/mol
LogP2.98
Rot. Bonds4

About N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide

N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide (PubChem CID 11748334) has the molecular formula C15H14ClNO3 and a molecular weight of 291.73 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
PubChem CID11748334
Molecular FormulaC15H14ClNO3
Molecular Weight291.73 g/mol
Exact Mass291.07
IUPAC NameN-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NCc2ccc(Cl)cc2)c1O
InChIInChI=1S/C15H14ClNO3/c1-20-13-4-2-3-12(14(13)18)15(19)17-9-10-5-7-11(16)8-6-10/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyCLHKDIZPHVXESB-UHFFFAOYSA-N
XLogP2.98
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.73
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)methyl]-2,3-dimethoxybenzamide
CID 912340
N-[(2,5-difluorophenyl)methyl]-2-hydroxy-3-methoxybenzamide
CID 63373922
2-hydroxy-3-methoxy-N-[(1-methylpyrrol-3-yl)methyl]benzamide
CID 103721972
N-(5-chloro-2-pyridinyl)-2-hydroxy-3-methoxybenzamide
CID 28831584
5-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 2671578
N-[(4-chlorophenyl)methyl]-2-fluoro-3-methylbenzamide
CID 80718402
2-hydroxy-3-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 43242463
4-chloro-N-[(3-chlorophenyl)methyl]-2-methoxybenzamide
CID 47449773
4-chloro-2-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 47449992
N-(2,2-dimethylpropyl)-2-hydroxy-3-methoxybenzamide
CID 61166501
N-[(3-chloro-4-fluorophenyl)methyl]-2,6-dimethoxybenzamide
CID 110784344
2-hydroxy-N-(2-hydroxy-2-methylpropyl)-3-methoxybenzamide
CID 65109444

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide (CID 11748334) is N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide is COc1cccc(C(=O)NCc2ccc(Cl)cc2)c1O.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
The InChIKey is CLHKDIZPHVXESB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3/c1-20-13-4-2-3-12(14(13)18)15(19)17-9-10-5-7-11(16)8-6-10/h2-8,18H,9H2,1H3,(H,17,19).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide?
N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide has a molecular weight of 291.73 g/mol, XLogP of 2.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 11748334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).