N-(1-cyanocycloheptyl)cyclohexanesulfonamide

C14H24N2O2S — CID 61122696

IUPACN-(1-cyanocycloheptyl)cyclohexanesulfonamide
SMILESN#CC1(NS(=O)(=O)C2CCCCC2)CCCCCC1
InChIInChI=1S/C14H24N2O2S/c15-12-14(10-6-1-2-7-11-14)16-19(17,18)13-8-4-3-5-9-13/h13,16H,1-11H2
InChIKeyGQAUOBHEZZRBJP-UHFFFAOYSA-N
MW284.42 g/mol
LogP2.86
Rot. Bonds3

About N-(1-cyanocycloheptyl)cyclohexanesulfonamide

N-(1-cyanocycloheptyl)cyclohexanesulfonamide (PubChem CID 61122696) has the molecular formula C14H24N2O2S and a molecular weight of 284.42 g/mol. Its IUPAC name is N-(1-cyanocycloheptyl)cyclohexanesulfonamide.

Molecular Properties

Compound NameN-(1-cyanocycloheptyl)cyclohexanesulfonamide
PubChem CID61122696
Molecular FormulaC14H24N2O2S
Molecular Weight284.42 g/mol
Exact Mass284.16
IUPAC NameN-(1-cyanocycloheptyl)cyclohexanesulfonamide
SMILESN#CC1(NS(=O)(=O)C2CCCCC2)CCCCCC1
InChIInChI=1S/C14H24N2O2S/c15-12-14(10-6-1-2-7-11-14)16-19(17,18)13-8-4-3-5-9-13/h13,16H,1-11H2
InChIKeyGQAUOBHEZZRBJP-UHFFFAOYSA-N
XLogP2.86
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.42
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-Cyano-3-methylcyclohexyl)ethanesulfonamide
CID 86799164
N-(1-cyanocyclohexyl)-4,4,4-trifluorobutane-1-sulfonamide
CID 83059396
N-(1-cyanocycloheptyl)-4,4,4-trifluorobutane-1-sulfonamide
CID 83059697
3-chloro-N-(1-cyanocycloheptyl)propane-1-sulfonamide
CID 43654150
N-(1-cyanocyclopentyl)-1-cyclohexylmethanesulfonamide
CID 54947838
N-(1-cyanocycloheptyl)-2-methoxyethanesulfonamide
CID 55014582
N-(1-cyano-4-methylcyclohexyl)ethanesulfonamide
CID 55138338
N-(1-cyano-4-ethylcyclohexyl)ethanesulfonamide
CID 55138339
N-(1-cyanocycloheptyl)-3-methylbutane-1-sulfonamide
CID 55259191
N-[(1-aminocycloheptyl)methyl]cyclohexanesulfonamide
CID 61064596
N-[1-(aminomethyl)cycloheptyl]cyclohexanesulfonamide
CID 61065632
N-(1-cyanocyclohexyl)propane-2-sulfonamide
CID 61122084

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocycloheptyl)cyclohexanesulfonamide?
The IUPAC name of N-(1-cyanocycloheptyl)cyclohexanesulfonamide (CID 61122696) is N-(1-cyanocycloheptyl)cyclohexanesulfonamide.
What is the SMILES notation for N-(1-cyanocycloheptyl)cyclohexanesulfonamide?
The canonical SMILES for N-(1-cyanocycloheptyl)cyclohexanesulfonamide is N#CC1(NS(=O)(=O)C2CCCCC2)CCCCCC1.
What is the InChIKey of N-(1-cyanocycloheptyl)cyclohexanesulfonamide?
The InChIKey is GQAUOBHEZZRBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S/c15-12-14(10-6-1-2-7-11-14)16-19(17,18)13-8-4-3-5-9-13/h13,16H,1-11H2.
What are the key properties of N-(1-cyanocycloheptyl)cyclohexanesulfonamide?
N-(1-cyanocycloheptyl)cyclohexanesulfonamide has a molecular weight of 284.42 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocycloheptyl)cyclohexanesulfonamide is sourced from PubChem (CID 61122696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).