N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide

C23H22N2O3 — CID 26549729

IUPACN-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide
SMILESCOc1ccc(CNC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C23H22N2O3/c1-16-6-5-7-18(14-16)22(26)25-21-9-4-3-8-20(21)23(27)24-15-17-10-12-19(28-2)13-11-17/h3-14H,15H2,1-2H3,(H,24,27)(H,25,26)
InChIKeyPWHATNUHBOTBBW-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.19
Rot. Bonds6

About N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide

N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide (PubChem CID 26549729) has the molecular formula C23H22N2O3 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide
PubChem CID26549729
Molecular FormulaC23H22N2O3
Molecular Weight374.44 g/mol
Exact Mass374.16
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide
SMILESCOc1ccc(CNC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C23H22N2O3/c1-16-6-5-7-18(14-16)22(26)25-21-9-4-3-8-20(21)23(27)24-15-17-10-12-19(28-2)13-11-17/h3-14H,15H2,1-2H3,(H,24,27)(H,25,26)
InChIKeyPWHATNUHBOTBBW-UHFFFAOYSA-N
XLogP4.19
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-N-[(4-methoxyphenyl)methyl]benzamide
CID 3350357
2-benzamido-N-[(3,5-dimethoxyphenyl)methyl]benzamide
CID 55576558
2-[(2-bromobenzoyl)amino]-N-[(4-methoxyphenyl)methyl]benzamide
CID 26549860
N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methylbenzoyl)amino]benzamide
CID 8873849
3,4,5-trimethoxy-N-[2-[(4-methylphenyl)methylcarbamoyl]phenyl]benzamide
CID 17320425
N-[2-[(4-methoxyphenyl)methylcarbamoyl]phenyl]furan-2-carboxamide
CID 17440926
2-[(4-methoxybenzoyl)amino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide
CID 17418127
N-[2-(4-fluorophenyl)ethyl]-2-[(3-methylbenzoyl)amino]benzamide
CID 26549728
N-benzyl-2-[(3-ethoxybenzoyl)amino]benzamide
CID 4957453
2-[[2-(3-methoxyphenoxy)acetyl]amino]-N-[(4-methylphenyl)methyl]benzamide
CID 112787422
2-[(4-methoxybenzoyl)amino]-N-[[3-(methylsulfamoyl)phenyl]methyl]benzamide
CID 55656448
N-[2-(benzylcarbamoyl)phenyl]-2,4-dimethoxybenzamide
CID 3662059

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide (CID 26549729) is N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide is COc1ccc(CNC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide?
The InChIKey is PWHATNUHBOTBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O3/c1-16-6-5-7-18(14-16)22(26)25-21-9-4-3-8-20(21)23(27)24-15-17-10-12-19(28-2)13-11-17/h3-14H,15H2,1-2H3,(H,24,27)(H,25,26).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide?
N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide has a molecular weight of 374.44 g/mol, XLogP of 4.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-[(3-methylbenzoyl)amino]benzamide is sourced from PubChem (CID 26549729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).