2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide

C14H19ClN2O3S — CID 4800085

IUPAC2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide
SMILESO=C(CNS(=O)(=O)c1ccc(Cl)cc1)NC1CCCCC1
InChIInChI=1S/C14H19ClN2O3S/c15-11-6-8-13(9-7-11)21(19,20)16-10-14(18)17-12-4-2-1-3-5-12/h6-9,12,16H,1-5,10H2,(H,17,18)
InChIKeyYAQQTGPEIOVQIQ-UHFFFAOYSA-N
MW330.84 g/mol
LogP2.07
Rot. Bonds5

About 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide

2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide (PubChem CID 4800085) has the molecular formula C14H19ClN2O3S and a molecular weight of 330.84 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide
PubChem CID4800085
Molecular FormulaC14H19ClN2O3S
Molecular Weight330.84 g/mol
Exact Mass330.08
IUPAC Name2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide
SMILESO=C(CNS(=O)(=O)c1ccc(Cl)cc1)NC1CCCCC1
InChIInChI=1S/C14H19ClN2O3S/c15-11-6-8-13(9-7-11)21(19,20)16-10-14(18)17-12-4-2-1-3-5-12/h6-9,12,16H,1-5,10H2,(H,17,18)
InChIKeyYAQQTGPEIOVQIQ-UHFFFAOYSA-N
XLogP2.07
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.84
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide (CID 4800085) is 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide is O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NC1CCCCC1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide?
The InChIKey is YAQQTGPEIOVQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3S/c15-11-6-8-13(9-7-11)21(19,20)16-10-14(18)17-12-4-2-1-3-5-12/h6-9,12,16H,1-5,10H2,(H,17,18).
What are the key properties of 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide?
2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide has a molecular weight of 330.84 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonylamino]-N-cyclohexylacetamide is sourced from PubChem (CID 4800085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).