2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide

C15H14ClNO3S — CID 1488248

IUPAC2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CS(=O)(=O)c1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C15H14ClNO3S/c1-17(13-7-3-2-4-8-13)15(18)11-21(19,20)14-9-5-6-12(16)10-14/h2-10H,11H2,1H3
InChIKeySLLOIXJZWAYOAL-UHFFFAOYSA-N
MW323.80 g/mol
LogP2.78
Rot. Bonds4

About 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide

2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide (PubChem CID 1488248) has the molecular formula C15H14ClNO3S and a molecular weight of 323.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide
PubChem CID1488248
Molecular FormulaC15H14ClNO3S
Molecular Weight323.80 g/mol
Exact Mass323.04
IUPAC Name2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CS(=O)(=O)c1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C15H14ClNO3S/c1-17(13-7-3-2-4-8-13)15(18)11-21(19,20)14-9-5-6-12(16)10-14/h2-10H,11H2,1H3
InChIKeySLLOIXJZWAYOAL-UHFFFAOYSA-N
XLogP2.78
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.80
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide?
The IUPAC name of 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide (CID 1488248) is 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide is CN(C(=O)CS(=O)(=O)c1cccc(Cl)c1)c1ccccc1.
What is the InChIKey of 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide?
The InChIKey is SLLOIXJZWAYOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO3S/c1-17(13-7-3-2-4-8-13)15(18)11-21(19,20)14-9-5-6-12(16)10-14/h2-10H,11H2,1H3.
What are the key properties of 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide?
2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide has a molecular weight of 323.80 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)sulfonyl-N-methyl-N-phenylacetamide is sourced from PubChem (CID 1488248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).