N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide

C23H22N2O4 — CID 110602599

IUPACN-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide
SMILESCOc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(C)cc2)cc1OC
InChIInChI=1S/C23H22N2O4/c1-15-8-10-16(11-9-15)22(26)25-19-7-5-4-6-18(19)23(27)24-17-12-13-20(28-2)21(14-17)29-3/h4-14H,1-3H3,(H,24,27)(H,25,26)
InChIKeyAIZKXNDGWQEGIM-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.52
Rot. Bonds6

About N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide

N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide (PubChem CID 110602599) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide
PubChem CID110602599
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC NameN-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide
SMILESCOc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(C)cc2)cc1OC
InChIInChI=1S/C23H22N2O4/c1-15-8-10-16(11-9-15)22(26)25-19-7-5-4-6-18(19)23(27)24-17-12-13-20(28-2)21(14-17)29-3/h4-14H,1-3H3,(H,24,27)(H,25,26)
InChIKeyAIZKXNDGWQEGIM-UHFFFAOYSA-N
XLogP4.52
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-N-(3,4-dimethoxyphenyl)-4-N-(2-methylphenyl)benzene-1,4-dicarboxamide
CID 109049317
N-[2-[(3-chloro-4-methoxyphenyl)carbamoyl]phenyl]-3,4-dimethoxybenzamide
CID 2185661
1-N,4-N-bis[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzene-1,4-dicarboxamide
CID 4945134
2-[(4-methylbenzoyl)amino]-N-phenylbenzamide
CID 913419
N-(2-acetylphenyl)-3,4-dimethoxybenzamide
CID 17394178
N-(3,4-dimethylphenyl)-2-[(4-phenylbenzoyl)amino]benzamide
CID 4944335
N-(3,4-dimethoxyphenyl)-2-hydroxybenzamide
CID 18105958
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-2,5-dimethylbenzamide
CID 9245041
2-methoxy-4-[(4-methylbenzoyl)amino]benzoic acid
CID 107208693
5-bromo-N-[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]-2-methoxybenzamide
CID 17094295
N-[4-(difluoromethoxy)-3-methoxyphenyl]-4-methylbenzamide
CID 4865288
1-N-(3,4-dimethoxyphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide
CID 126493303

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide (CID 110602599) is N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide is COc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(C)cc2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide?
The InChIKey is AIZKXNDGWQEGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-15-8-10-16(11-9-15)22(26)25-19-7-5-4-6-18(19)23(27)24-17-12-13-20(28-2)21(14-17)29-3/h4-14H,1-3H3,(H,24,27)(H,25,26).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide?
N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide has a molecular weight of 390.44 g/mol, XLogP of 4.52, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-[(4-methylbenzoyl)amino]benzamide is sourced from PubChem (CID 110602599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).