3-cyano-N-(3-methoxyphenyl)benzamide

C15H12N2O2 — CID 2709744

IUPAC3-cyano-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2cccc(C#N)c2)c1
InChIInChI=1S/C15H12N2O2/c1-19-14-7-3-6-13(9-14)17-15(18)12-5-2-4-11(8-12)10-16/h2-9H,1H3,(H,17,18)
InChIKeyRHYJMLLWIPXXIE-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.82
Rot. Bonds3

About 3-cyano-N-(3-methoxyphenyl)benzamide

3-cyano-N-(3-methoxyphenyl)benzamide (PubChem CID 2709744) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 3-cyano-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3-cyano-N-(3-methoxyphenyl)benzamide
PubChem CID2709744
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name3-cyano-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2cccc(C#N)c2)c1
InChIInChI=1S/C15H12N2O2/c1-19-14-7-3-6-13(9-14)17-15(18)12-5-2-4-11(8-12)10-16/h2-9H,1H3,(H,17,18)
InChIKeyRHYJMLLWIPXXIE-UHFFFAOYSA-N
XLogP2.82
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N-(3-cyanophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057633
N-(3-cyanophenyl)-3-methoxybenzamide
CID 2707607
3-N-(2-cyanophenyl)-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057632
3-(3-hydroxyprop-1-ynyl)-N-(3-methoxyphenyl)benzamide
CID 60815302
3-cyano-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 9414207
3-cyano-N-(3-pyridin-3-yloxyphenyl)benzamide
CID 58337716
1-N-(3-acetylphenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057624
3-N-(3-methoxyphenyl)-1-N-(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057620
N-(3-cyanophenyl)-N'-(3-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969395
2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093044
3-(carbamoylamino)-N-(3-methoxyphenyl)benzamide
CID 29199856
methyl 4-[[3-[(3-cyanophenyl)carbamoyl]benzoyl]amino]benzoate
CID 109057740

Frequently Asked Questions

What is the IUPAC name of 3-cyano-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 3-cyano-N-(3-methoxyphenyl)benzamide (CID 2709744) is 3-cyano-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 3-cyano-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 3-cyano-N-(3-methoxyphenyl)benzamide is COc1cccc(NC(=O)c2cccc(C#N)c2)c1.
What is the InChIKey of 3-cyano-N-(3-methoxyphenyl)benzamide?
The InChIKey is RHYJMLLWIPXXIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-19-14-7-3-6-13(9-14)17-15(18)12-5-2-4-11(8-12)10-16/h2-9H,1H3,(H,17,18).
What are the key properties of 3-cyano-N-(3-methoxyphenyl)benzamide?
3-cyano-N-(3-methoxyphenyl)benzamide has a molecular weight of 252.27 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyano-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 2709744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).