N-(2-cyanocyclopentyl)cyclohexanesulfonamide

C12H20N2O2S — CID 62962900

IUPACN-(2-cyanocyclopentyl)cyclohexanesulfonamide
SMILESN#CC1CCCC1NS(=O)(=O)C1CCCCC1
InChIInChI=1S/C12H20N2O2S/c13-9-10-5-4-8-12(10)14-17(15,16)11-6-2-1-3-7-11/h10-12,14H,1-8H2
InChIKeyHFVDUVAEGZAQAZ-UHFFFAOYSA-N
MW256.37 g/mol
LogP1.93
Rot. Bonds3

About N-(2-cyanocyclopentyl)cyclohexanesulfonamide

N-(2-cyanocyclopentyl)cyclohexanesulfonamide (PubChem CID 62962900) has the molecular formula C12H20N2O2S and a molecular weight of 256.37 g/mol. Its IUPAC name is N-(2-cyanocyclopentyl)cyclohexanesulfonamide.

Molecular Properties

Compound NameN-(2-cyanocyclopentyl)cyclohexanesulfonamide
PubChem CID62962900
Molecular FormulaC12H20N2O2S
Molecular Weight256.37 g/mol
Exact Mass256.12
IUPAC NameN-(2-cyanocyclopentyl)cyclohexanesulfonamide
SMILESN#CC1CCCC1NS(=O)(=O)C1CCCCC1
InChIInChI=1S/C12H20N2O2S/c13-9-10-5-4-8-12(10)14-17(15,16)11-6-2-1-3-7-11/h10-12,14H,1-8H2
InChIKeyHFVDUVAEGZAQAZ-UHFFFAOYSA-N
XLogP1.93
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyanocyclopentyl)cyclohexanesulfonamide?
The IUPAC name of N-(2-cyanocyclopentyl)cyclohexanesulfonamide (CID 62962900) is N-(2-cyanocyclopentyl)cyclohexanesulfonamide.
What is the SMILES notation for N-(2-cyanocyclopentyl)cyclohexanesulfonamide?
The canonical SMILES for N-(2-cyanocyclopentyl)cyclohexanesulfonamide is N#CC1CCCC1NS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-(2-cyanocyclopentyl)cyclohexanesulfonamide?
The InChIKey is HFVDUVAEGZAQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S/c13-9-10-5-4-8-12(10)14-17(15,16)11-6-2-1-3-7-11/h10-12,14H,1-8H2.
What are the key properties of N-(2-cyanocyclopentyl)cyclohexanesulfonamide?
N-(2-cyanocyclopentyl)cyclohexanesulfonamide has a molecular weight of 256.37 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanocyclopentyl)cyclohexanesulfonamide is sourced from PubChem (CID 62962900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).