N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide

C15H12N2O3 — CID 24706951

IUPACN-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2cccc(C#N)c2)c1O
InChIInChI=1S/C15H12N2O3/c1-20-13-7-3-6-12(14(13)18)15(19)17-11-5-2-4-10(8-11)9-16/h2-8,18H,1H3,(H,17,19)
InChIKeyJFCDZWBCAXKJDM-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.52
Rot. Bonds3

About N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide

N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide (PubChem CID 24706951) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide
PubChem CID24706951
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC NameN-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2cccc(C#N)c2)c1O
InChIInChI=1S/C15H12N2O3/c1-20-13-7-3-6-12(14(13)18)15(19)17-11-5-2-4-10(8-11)9-16/h2-8,18H,1H3,(H,17,19)
InChIKeyJFCDZWBCAXKJDM-UHFFFAOYSA-N
XLogP2.52
TPSA82.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-(3-hydroxyphenyl)-3-methoxybenzamide
CID 28739843
N-(3-cyanophenyl)-2-methoxypyridine-3-carboxamide
CID 55023858
4-bromo-N-(3-cyanophenyl)-3,5-dimethoxybenzamide
CID 9083182
2-(2-amino-2-oxoethoxy)-N-(3-cyanophenyl)benzamide
CID 34795688
N-(4-cyano-2-methoxyphenyl)-2,3-dihydroxybenzamide
CID 114343595
1-N-(3-cyanophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057633
N-[3-(3-aminoprop-1-ynyl)phenyl]-2-methoxybenzamide
CID 60802580
N-(3-cyanophenyl)-7-methoxy-1H-indole-2-carboxamide
CID 110864739
N-(3-cyanophenyl)-3-methoxybenzamide
CID 2707607
N-(3-amino-4-ethylphenyl)-2-hydroxy-3-methoxybenzamide
CID 43550234
N-(3-cyanophenyl)-7-methoxy-2-methyl-1H-indole-3-carboxamide
CID 110864775
3-cyano-N-(3-methoxyphenyl)benzamide
CID 2709744

Frequently Asked Questions

What is the IUPAC name of N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide?
The IUPAC name of N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide (CID 24706951) is N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide.
What is the SMILES notation for N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide?
The canonical SMILES for N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide is COc1cccc(C(=O)Nc2cccc(C#N)c2)c1O.
What is the InChIKey of N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide?
The InChIKey is JFCDZWBCAXKJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c1-20-13-7-3-6-12(14(13)18)15(19)17-11-5-2-4-10(8-11)9-16/h2-8,18H,1H3,(H,17,19).
What are the key properties of N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide?
N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide has a molecular weight of 268.27 g/mol, XLogP of 2.52, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyanophenyl)-2-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 24706951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).