2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide

C17H17ClN2O2 — CID 44579191

IUPAC2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide
SMILESCC(=O)NCC(=O)NC(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O2/c1-12(21)19-11-16(22)20-17(13-5-3-2-4-6-13)14-7-9-15(18)10-8-14/h2-10,17H,11H2,1H3,(H,19,21)(H,20,22)
InChIKeyQIIVIPMIUSRDGT-UHFFFAOYSA-N
MW316.79 g/mol
LogP2.68
Rot. Bonds5

About 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide

2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide (PubChem CID 44579191) has the molecular formula C17H17ClN2O2 and a molecular weight of 316.79 g/mol. Its IUPAC name is 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide
PubChem CID44579191
Molecular FormulaC17H17ClN2O2
Molecular Weight316.79 g/mol
Exact Mass316.10
IUPAC Name2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide
SMILESCC(=O)NCC(=O)NC(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O2/c1-12(21)19-11-16(22)20-17(13-5-3-2-4-6-13)14-7-9-15(18)10-8-14/h2-10,17H,11H2,1H3,(H,19,21)(H,20,22)
InChIKeyQIIVIPMIUSRDGT-UHFFFAOYSA-N
XLogP2.68
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.79
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide 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 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide?
The IUPAC name of 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide (CID 44579191) is 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide.
What is the SMILES notation for 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide?
The canonical SMILES for 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide is CC(=O)NCC(=O)NC(c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide?
The InChIKey is QIIVIPMIUSRDGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O2/c1-12(21)19-11-16(22)20-17(13-5-3-2-4-6-13)14-7-9-15(18)10-8-14/h2-10,17H,11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide?
2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide has a molecular weight of 316.79 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[(4-chlorophenyl)-phenylmethyl]acetamide is sourced from PubChem (CID 44579191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).