2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide

C16H14N2O — CID 134694438

IUPAC2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cc2ccccc2C#N)cc1
InChIInChI=1S/C16H14N2O/c1-12-6-8-15(9-7-12)18-16(19)10-13-4-2-3-5-14(13)11-17/h2-9H,10H2,1H3,(H,18,19)
InChIKeyWLYBNHIRTQZJTK-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.05
Rot. Bonds3

About 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide

2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide (PubChem CID 134694438) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide
PubChem CID134694438
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cc2ccccc2C#N)cc1
InChIInChI=1S/C16H14N2O/c1-12-6-8-15(9-7-12)18-16(19)10-13-4-2-3-5-14(13)11-17/h2-9H,10H2,1H3,(H,18,19)
InChIKeyWLYBNHIRTQZJTK-UHFFFAOYSA-N
XLogP3.05
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-cyanophenyl)methylsulfonyl]-N-(4-methylphenyl)acetamide
CID 39159153
[2-(2-cyanoanilino)-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 2462072
2-[2-(4-methylanilino)-2-oxoethyl]benzoic acid
CID 12558883
3-[(2-cyanophenyl)methoxy]-N-(4-methylphenyl)benzamide
CID 52738677
N-(3-cyano-4-fluorophenyl)-2-(2-methylphenyl)acetamide
CID 62315790
2-[3-(2-cyanophenyl)-2-oxopropyl]benzonitrile
CID 13459099
(2R)-2-(2-cyanophenoxy)-N-(4-methylphenyl)propanamide
CID 2565309
methyl 4-[[2-[(2-cyanophenyl)methylsulfanyl]acetyl]amino]benzoate
CID 8967384
2-cyano-N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]acetamide
CID 108922586
2-(2,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 7596977
N-(4-acetylphenyl)-2-(2-methylphenyl)acetamide
CID 24696355
N-(2-cyanophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80740419

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide (CID 134694438) is 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)Cc2ccccc2C#N)cc1.
What is the InChIKey of 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide?
The InChIKey is WLYBNHIRTQZJTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-12-6-8-15(9-7-12)18-16(19)10-13-4-2-3-5-14(13)11-17/h2-9H,10H2,1H3,(H,18,19).
What are the key properties of 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide?
2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide has a molecular weight of 250.30 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenyl)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 134694438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).