4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide

C20H24N2O2 — CID 17309184

IUPAC4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide
SMILESCCC(CC)C(=O)Nc1ccc(C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C20H24N2O2/c1-4-15(5-2)19(23)21-17-12-10-16(11-13-17)20(24)22-18-9-7-6-8-14(18)3/h6-13,15H,4-5H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyWBQRMJQOJYYWQM-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.62
Rot. Bonds6

About 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide

4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide (PubChem CID 17309184) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound Name4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide
PubChem CID17309184
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide
SMILESCCC(CC)C(=O)Nc1ccc(C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C20H24N2O2/c1-4-15(5-2)19(23)21-17-12-10-16(11-13-17)20(24)22-18-9-7-6-8-14(18)3/h6-13,15H,4-5H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyWBQRMJQOJYYWQM-UHFFFAOYSA-N
XLogP4.62
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dimethylphenyl)-4-(2-ethylbutanoylamino)benzamide
CID 17309087
N-(2,5-dimethylphenyl)-4-(2-ethylbutanoylamino)benzamide
CID 17309132
N-(3,5-dimethylphenyl)-4-(2-ethylbutanoylamino)benzamide
CID 17309070
N-(4-bromo-3-methylphenyl)-4-(2-ethylbutanoylamino)benzamide
CID 17309171
ethane;4-methyl-N-(2-methylphenyl)benzamide
CID 145337643
N-(2,3-dimethylphenyl)-4-(2-methylpropanoylamino)benzamide
CID 977709
3-methyl-N-[4-[(2-methylphenyl)carbamoyl]phenyl]benzamide
CID 23857052
4-(2-ethylbutanoylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 6458348
N-[4-[(2-methylphenyl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 2988389
dimethyl 2-[[4-(2-ethylbutanoylamino)benzoyl]amino]benzene-1,4-dicarboxylate
CID 17309062
4-tert-butyl-N-(2-methylphenyl)benzamide
CID 139185103
4-N-(2,6-dimethylphenyl)-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049294

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide?
The IUPAC name of 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide (CID 17309184) is 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide.
What is the SMILES notation for 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide?
The canonical SMILES for 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide is CCC(CC)C(=O)Nc1ccc(C(=O)Nc2ccccc2C)cc1.
What is the InChIKey of 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide?
The InChIKey is WBQRMJQOJYYWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-4-15(5-2)19(23)21-17-12-10-16(11-13-17)20(24)22-18-9-7-6-8-14(18)3/h6-13,15H,4-5H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide?
4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide has a molecular weight of 324.42 g/mol, XLogP of 4.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylbutanoylamino)-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 17309184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).