5-methyl-2-(4-methylphenyl)-N-phenylbenzamide

C21H19NO — CID 173213744

IUPAC5-methyl-2-(4-methylphenyl)-N-phenylbenzamide
SMILESCc1ccc(-c2ccc(C)cc2C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C21H19NO/c1-15-8-11-17(12-9-15)19-13-10-16(2)14-20(19)21(23)22-18-6-4-3-5-7-18/h3-14H,1-2H3,(H,22,23)
InChIKeyDYPXNAJVYYQBBN-UHFFFAOYSA-N
MW301.39 g/mol
LogP5.22
Rot. Bonds3

About 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide

5-methyl-2-(4-methylphenyl)-N-phenylbenzamide (PubChem CID 173213744) has the molecular formula C21H19NO and a molecular weight of 301.39 g/mol. Its IUPAC name is 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide.

Molecular Properties

Compound Name5-methyl-2-(4-methylphenyl)-N-phenylbenzamide
PubChem CID173213744
Molecular FormulaC21H19NO
Molecular Weight301.39 g/mol
Exact Mass301.15
IUPAC Name5-methyl-2-(4-methylphenyl)-N-phenylbenzamide
SMILESCc1ccc(-c2ccc(C)cc2C(=O)Nc2ccccc2)cc1
InChIInChI=1S/C21H19NO/c1-15-8-11-17(12-9-15)19-13-10-16(2)14-20(19)21(23)22-18-6-4-3-5-7-18/h3-14H,1-2H3,(H,22,23)
InChIKeyDYPXNAJVYYQBBN-UHFFFAOYSA-N
XLogP5.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.39
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-N-phenyl-2-pyridin-2-ylbenzamide
CID 102459618
N,5-dimethyl-2-phenylbenzamide
CID 154716266
3-[[2-(4-methylphenyl)benzoyl]amino]benzoic acid;hydrochloride
CID 70145450
2,5-bis(4-methylphenyl)-3-N,4-N-diphenylfuran-3,4-dicarboxamide
CID 10576901
2-(ethylamino)-5-methyl-N-phenylbenzamide
CID 62509479
N-[4-(ethylamino)phenyl]-2-(4-methylphenyl)benzamide
CID 141052756
2-(4-chlorophenyl)-N-phenylbenzamide
CID 102340259
2,5-dimethyl-N-phenylpyridine-3-carboxamide
CID 160655593
methyl 5-methyl-2-(4-methylphenyl)benzoate
CID 22125905
N-[2-[(2-hydroxyphenyl)-methylcarbamoyl]phenyl]-5-methyl-2-phenylbenzamide
CID 67698934
2,5-dimethyl-N-(3-methylphenyl)benzamide
CID 925357
2-[(4-methylbenzoyl)amino]-N-phenylbenzamide
CID 913419

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide?
The IUPAC name of 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide (CID 173213744) is 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide.
What is the SMILES notation for 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide?
The canonical SMILES for 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide is Cc1ccc(-c2ccc(C)cc2C(=O)Nc2ccccc2)cc1.
What is the InChIKey of 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide?
The InChIKey is DYPXNAJVYYQBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO/c1-15-8-11-17(12-9-15)19-13-10-16(2)14-20(19)21(23)22-18-6-4-3-5-7-18/h3-14H,1-2H3,(H,22,23).
What are the key properties of 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide?
5-methyl-2-(4-methylphenyl)-N-phenylbenzamide has a molecular weight of 301.39 g/mol, XLogP of 5.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-methylphenyl)-N-phenylbenzamide is sourced from PubChem (CID 173213744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).