2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide

C15H18ClF3N2O3S — CID 8713326

IUPAC2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide
SMILESO=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NC1CCCCC1
InChIInChI=1S/C15H18ClF3N2O3S/c16-12-7-6-10(15(17,18)19)8-13(12)25(23,24)20-9-14(22)21-11-4-2-1-3-5-11/h6-8,11,20H,1-5,9H2,(H,21,22)
InChIKeyXGIQQCOCNAZOHX-UHFFFAOYSA-N
MW398.83 g/mol
LogP3.09
Rot. Bonds5

About 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide

2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide (PubChem CID 8713326) has the molecular formula C15H18ClF3N2O3S and a molecular weight of 398.83 g/mol. Its IUPAC name is 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide
PubChem CID8713326
Molecular FormulaC15H18ClF3N2O3S
Molecular Weight398.83 g/mol
Exact Mass398.07
IUPAC Name2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide
SMILESO=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NC1CCCCC1
InChIInChI=1S/C15H18ClF3N2O3S/c16-12-7-6-10(15(17,18)19)8-13(12)25(23,24)20-9-14(22)21-11-4-2-1-3-5-11/h6-8,11,20H,1-5,9H2,(H,21,22)
InChIKeyXGIQQCOCNAZOHX-UHFFFAOYSA-N
XLogP3.09
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.83
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide?
The IUPAC name of 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide (CID 8713326) is 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide.
What is the SMILES notation for 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide?
The canonical SMILES for 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide is O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NC1CCCCC1.
What is the InChIKey of 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide?
The InChIKey is XGIQQCOCNAZOHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClF3N2O3S/c16-12-7-6-10(15(17,18)19)8-13(12)25(23,24)20-9-14(22)21-11-4-2-1-3-5-11/h6-8,11,20H,1-5,9H2,(H,21,22).
What are the key properties of 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide?
2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide has a molecular weight of 398.83 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-chloro-5-(trifluoromethyl)phenyl]sulfonylamino]-N-cyclohexylacetamide is sourced from PubChem (CID 8713326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).