2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide

C16H17ClN2O3S — CID 1330872

IUPAC2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide
SMILESNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O3S/c17-14-6-8-15(9-7-14)23(21,22)19(12-16(18)20)11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,18,20)
InChIKeyOTZYOJUFOUGZPN-UHFFFAOYSA-N
MW352.84 g/mol
LogP2.06
Rot. Bonds7

About 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide

2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide (PubChem CID 1330872) has the molecular formula C16H17ClN2O3S and a molecular weight of 352.84 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide
PubChem CID1330872
Molecular FormulaC16H17ClN2O3S
Molecular Weight352.84 g/mol
Exact Mass352.06
IUPAC Name2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide
SMILESNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O3S/c17-14-6-8-15(9-7-14)23(21,22)19(12-16(18)20)11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,18,20)
InChIKeyOTZYOJUFOUGZPN-UHFFFAOYSA-N
XLogP2.06
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]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-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide (CID 1330872) is 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide is NC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide?
The InChIKey is OTZYOJUFOUGZPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O3S/c17-14-6-8-15(9-7-14)23(21,22)19(12-16(18)20)11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,18,20).
What are the key properties of 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide?
2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide has a molecular weight of 352.84 g/mol, XLogP of 2.06, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonyl-(2-phenylethyl)amino]acetamide is sourced from PubChem (CID 1330872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).