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

C17H18N2O2 — CID 18104261

IUPAC4-(acetamidomethyl)-N-(2-methylphenyl)benzamide
SMILESCC(=O)NCc1ccc(C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C17H18N2O2/c1-12-5-3-4-6-16(12)19-17(21)15-9-7-14(8-10-15)11-18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyJFLIRTNGJYXCPN-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.88
Rot. Bonds4

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

4-(acetamidomethyl)-N-(2-methylphenyl)benzamide (PubChem CID 18104261) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound Name4-(acetamidomethyl)-N-(2-methylphenyl)benzamide
PubChem CID18104261
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name4-(acetamidomethyl)-N-(2-methylphenyl)benzamide
SMILESCC(=O)NCc1ccc(C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C17H18N2O2/c1-12-5-3-4-6-16(12)19-17(21)15-9-7-14(8-10-15)11-18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyJFLIRTNGJYXCPN-UHFFFAOYSA-N
XLogP2.88
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-[[4-(acetamidomethyl)benzoyl]amino]-4-methylbenzoate
CID 17439157
4-(acetamidomethyl)-N-(2-phenoxyphenyl)benzamide
CID 17417945
4-N-(2-methylphenyl)-1-N-[(3-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046884
4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide
CID 18195087
ethane;4-methyl-N-(2-methylphenyl)benzamide
CID 145337643
4-(acetamidomethyl)-N-(4-phenylphenyl)benzamide
CID 78805930
4-(acetamidomethyl)-N-quinolin-8-ylbenzamide
CID 18196066
4-tert-butyl-N-(2-methylphenyl)benzamide
CID 139185103
4-N-(2,6-dimethylphenyl)-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049294
1-N-[2-(4-fluorophenyl)ethyl]-4-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109047991
4-(acetamidomethyl)-N-(2,4-difluorophenyl)benzamide
CID 18195856
4-N-benzyl-4-N-methyl-1-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109047105

Frequently Asked Questions

What is the IUPAC name of 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide?
The IUPAC name of 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide (CID 18104261) is 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide.
What is the SMILES notation for 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide?
The canonical SMILES for 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide is CC(=O)NCc1ccc(C(=O)Nc2ccccc2C)cc1.
What is the InChIKey of 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide?
The InChIKey is JFLIRTNGJYXCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12-5-3-4-6-16(12)19-17(21)15-9-7-14(8-10-15)11-18-13(2)20/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide?
4-(acetamidomethyl)-N-(2-methylphenyl)benzamide has a molecular weight of 282.34 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(acetamidomethyl)-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 18104261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).