N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide

C22H17N3O2 — CID 27843811

IUPACN-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1
InChIInChI=1S/C22H17N3O2/c1-15(26)24-17-10-12-18(13-11-17)25-22(27)21-9-5-4-8-20(21)19-7-3-2-6-16(19)14-23/h2-13H,1H3,(H,24,26)(H,25,27)
InChIKeyPIBSZKYVAVQYBX-UHFFFAOYSA-N
MW355.40 g/mol
LogP4.44
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide

N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide (PubChem CID 27843811) has the molecular formula C22H17N3O2 and a molecular weight of 355.40 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide
PubChem CID27843811
Molecular FormulaC22H17N3O2
Molecular Weight355.40 g/mol
Exact Mass355.13
IUPAC NameN-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1
InChIInChI=1S/C22H17N3O2/c1-15(26)24-17-10-12-18(13-11-17)25-22(27)21-9-5-4-8-20(21)19-7-3-2-6-16(19)14-23/h2-13H,1H3,(H,24,26)(H,25,27)
InChIKeyPIBSZKYVAVQYBX-UHFFFAOYSA-N
XLogP4.44
TPSA81.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.40
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[(4-acetamidophenyl)carbamoyl]phenyl]benzoic acid
CID 1113667
2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide
CID 51255858
methyl 3-[[2-(2-cyanophenyl)benzoyl]amino]benzoate
CID 27846126
N-(2-chlorophenyl)-2-(2-cyanophenyl)benzamide
CID 16560997
2-(2-cyanophenyl)-N-(3-nitrophenyl)benzamide
CID 32989896
2-(2-cyanophenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)benzamide
CID 9360404
[(2S)-1-(4-acetylanilino)-1-oxopropan-2-yl] 2-(2-cyanophenyl)benzoate
CID 7522056
[(2R)-1-(4-acetylanilino)-1-oxopropan-2-yl] 2-(2-cyanophenyl)benzoate
CID 7522074
2-chloro-4-[[2-(2-cyanophenyl)benzoyl]amino]-N-(2-methoxyethyl)benzamide
CID 55877380
4-[[2-(2-cyanophenyl)benzoyl]amino]-3-methylbenzamide
CID 51114705
2-(2-cyanophenyl)-N-[4-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)phenyl]benzamide
CID 112833070
[2-(4-methoxyanilino)-2-oxoethyl] 2-(2-cyanophenyl)benzoate
CID 8701813

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide (CID 27843811) is N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide is CC(=O)Nc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide?
The InChIKey is PIBSZKYVAVQYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O2/c1-15(26)24-17-10-12-18(13-11-17)25-22(27)21-9-5-4-8-20(21)19-7-3-2-6-16(19)14-23/h2-13H,1H3,(H,24,26)(H,25,27).
What are the key properties of N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide?
N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide has a molecular weight of 355.40 g/mol, XLogP of 4.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2-cyanophenyl)benzamide is sourced from PubChem (CID 27843811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).