4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide

C23H21ClN2O3 — CID 1228500

IUPAC4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
SMILESCOc1ccc(C(=O)Nc2cc(C(=O)NCCc3ccccc3)ccc2Cl)cc1
InChIInChI=1S/C23H21ClN2O3/c1-29-19-10-7-17(8-11-19)23(28)26-21-15-18(9-12-20(21)24)22(27)25-14-13-16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3,(H,25,27)(H,26,28)
InChIKeyCZGPJQVOFRJKMO-UHFFFAOYSA-N
MW408.89 g/mol
LogP4.57
Rot. Bonds7

About 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide

4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide (PubChem CID 1228500) has the molecular formula C23H21ClN2O3 and a molecular weight of 408.89 g/mol. Its IUPAC name is 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound Name4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
PubChem CID1228500
Molecular FormulaC23H21ClN2O3
Molecular Weight408.89 g/mol
Exact Mass408.12
IUPAC Name4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
SMILESCOc1ccc(C(=O)Nc2cc(C(=O)NCCc3ccccc3)ccc2Cl)cc1
InChIInChI=1S/C23H21ClN2O3/c1-29-19-10-7-17(8-11-19)23(28)26-21-15-18(9-12-20(21)24)22(27)25-14-13-16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3,(H,25,27)(H,26,28)
InChIKeyCZGPJQVOFRJKMO-UHFFFAOYSA-N
XLogP4.57
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.89
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide?
The IUPAC name of 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide (CID 1228500) is 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide.
What is the SMILES notation for 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide?
The canonical SMILES for 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide is COc1ccc(C(=O)Nc2cc(C(=O)NCCc3ccccc3)ccc2Cl)cc1.
What is the InChIKey of 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide?
The InChIKey is CZGPJQVOFRJKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN2O3/c1-29-19-10-7-17(8-11-19)23(28)26-21-15-18(9-12-20(21)24)22(27)25-14-13-16-5-3-2-4-6-16/h2-12,15H,13-14H2,1H3,(H,25,27)(H,26,28).
What are the key properties of 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide?
4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide has a molecular weight of 408.89 g/mol, XLogP of 4.57, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-[(4-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 1228500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).