N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide

C22H21N3O3 — CID 3546373

IUPACN-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide
SMILESCOc1cc(NC(=O)c2ccccc2)c(C)cc1NC(=O)Nc1ccccc1
InChIInChI=1S/C22H21N3O3/c1-15-13-19(25-22(27)23-17-11-7-4-8-12-17)20(28-2)14-18(15)24-21(26)16-9-5-3-6-10-16/h3-14H,1-2H3,(H,24,26)(H2,23,25,27)
InChIKeyVOKXTLLSRGWJDU-UHFFFAOYSA-N
MW375.43 g/mol
LogP4.90
Rot. Bonds5

About N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide

N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide (PubChem CID 3546373) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide.

Molecular Properties

Compound NameN-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide
PubChem CID3546373
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC NameN-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide
SMILESCOc1cc(NC(=O)c2ccccc2)c(C)cc1NC(=O)Nc1ccccc1
InChIInChI=1S/C22H21N3O3/c1-15-13-19(25-22(27)23-17-11-7-4-8-12-17)20(28-2)14-18(15)24-21(26)16-9-5-3-6-10-16/h3-14H,1-2H3,(H,24,26)(H2,23,25,27)
InChIKeyVOKXTLLSRGWJDU-UHFFFAOYSA-N
XLogP4.90
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 54.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-benzamido-2,5-dimethoxyphenyl)benzamide
CID 1053126
N-[4-[(3-chlorophenyl)carbamoylamino]-2,5-dimethoxyphenyl]benzamide
CID 19187598
N-(4-benzamido-2-methoxy-5-methylphenyl)thiophene-2-carboxamide
CID 4304532
N-[4-(fluoroamino)-2,5-dimethoxyphenyl]benzamide
CID 142075014
N-[4-(chlorodiazenyl)-5-methoxy-2-methylphenyl]benzamide
CID 50936931
4-benzamido-5-methoxy-2-methylbenzenediazonium
CID 23558418
1-(5-hydroxy-2,4-dimethoxyphenyl)-3-phenylurea
CID 22099500
N-(5-chloro-2,4-dimethoxyphenyl)benzamide
CID 835257
4-benzamido-2,5-dimethoxybenzenesulfonic acid
CID 102438408
N-(4-amino-2,5-dimethoxyphenyl)benzamide;ethane;molecular hydrogen
CID 142075017
N-(2-amino-5-methoxy-4-methylphenyl)benzamide;hydrochloride
CID 172831967
2,6-dimethoxy-N-[2-methyl-5-(phenylcarbamoyl)phenyl]benzamide
CID 154838760

Frequently Asked Questions

What is the IUPAC name of N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide?
The IUPAC name of N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide (CID 3546373) is N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide.
What is the SMILES notation for N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide?
The canonical SMILES for N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide is COc1cc(NC(=O)c2ccccc2)c(C)cc1NC(=O)Nc1ccccc1.
What is the InChIKey of N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide?
The InChIKey is VOKXTLLSRGWJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-15-13-19(25-22(27)23-17-11-7-4-8-12-17)20(28-2)14-18(15)24-21(26)16-9-5-3-6-10-16/h3-14H,1-2H3,(H,24,26)(H2,23,25,27).
What are the key properties of N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide?
N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide has a molecular weight of 375.43 g/mol, XLogP of 4.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methoxy-2-methyl-4-(phenylcarbamoylamino)phenyl]benzamide is sourced from PubChem (CID 3546373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).