N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide

C16H15ClN2O2 — CID 2410263

IUPACN-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1)NCc1ccc(Cl)cc1
InChIInChI=1S/C16H15ClN2O2/c17-14-8-6-12(7-9-14)10-18-15(20)11-19-16(21)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,19,21)
InChIKeyIKBYRSNNVRLVNY-UHFFFAOYSA-N
MW302.76 g/mol
LogP2.39
Rot. Bonds5

About N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide

N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide (PubChem CID 2410263) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide
PubChem CID2410263
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC NameN-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1)NCc1ccc(Cl)cc1
InChIInChI=1S/C16H15ClN2O2/c17-14-8-6-12(7-9-14)10-18-15(20)11-19-16(21)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,19,21)
InChIKeyIKBYRSNNVRLVNY-UHFFFAOYSA-N
XLogP2.39
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]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 N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide (CID 2410263) is N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide is O=C(CNC(=O)c1ccccc1)NCc1ccc(Cl)cc1.
What is the InChIKey of N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide?
The InChIKey is IKBYRSNNVRLVNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c17-14-8-6-12(7-9-14)10-18-15(20)11-19-16(21)13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,19,21).
What are the key properties of N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide?
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide has a molecular weight of 302.76 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 2410263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).