N-(2-cyanopropyl)cyclohexanesulfonamide

C10H18N2O2S — CID 62651123

IUPACN-(2-cyanopropyl)cyclohexanesulfonamide
SMILESCC(C#N)CNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C10H18N2O2S/c1-9(7-11)8-12-15(13,14)10-5-3-2-4-6-10/h9-10,12H,2-6,8H2,1H3
InChIKeyCQZGCUKJKMKXPC-UHFFFAOYSA-N
MW230.33 g/mol
LogP1.40
Rot. Bonds4

About N-(2-cyanopropyl)cyclohexanesulfonamide

N-(2-cyanopropyl)cyclohexanesulfonamide (PubChem CID 62651123) has the molecular formula C10H18N2O2S and a molecular weight of 230.33 g/mol. Its IUPAC name is N-(2-cyanopropyl)cyclohexanesulfonamide.

Molecular Properties

Compound NameN-(2-cyanopropyl)cyclohexanesulfonamide
PubChem CID62651123
Molecular FormulaC10H18N2O2S
Molecular Weight230.33 g/mol
Exact Mass230.11
IUPAC NameN-(2-cyanopropyl)cyclohexanesulfonamide
SMILESCC(C#N)CNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C10H18N2O2S/c1-9(7-11)8-12-15(13,14)10-5-3-2-4-6-10/h9-10,12H,2-6,8H2,1H3
InChIKeyCQZGCUKJKMKXPC-UHFFFAOYSA-N
XLogP1.40
TPSA69.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyanopropyl)cyclohexanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-cyanopropyl)oxane-4-sulfonamide
CID 62653493
methyl 2-(2-cyanopropylsulfamoyl)cyclohexane-1-carboxylate
CID 75455830
N-(3-chloro-2-methylpropyl)cyclopentanesulfonamide
CID 105361722
N-(2-ethylbutyl)cyclopentanesulfonamide
CID 115613328
N-(2-bromo-4-methylpentyl)cyclopentanesulfonamide
CID 107158183
N-(4-chloro-2-methylbutyl)cyclopentanesulfonamide
CID 105361729
N-(2-amino-4-methylpentyl)cyclopentanesulfonamide
CID 105361370
N-(3-bromobutyl)cyclohexanesulfonamide
CID 114297660
N-(3,3,3-trifluoro-2-hydroxypropyl)cyclohexanesulfonamide
CID 113242615
methyl 3-(cyclohexylsulfonylamino)-2-hydroxypropanoate
CID 113356681
2-methyl-3-(methylsulfamoylamino)propanenitrile
CID 114807843
N-[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]cyclohexanesulfonamide
CID 71997349

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanopropyl)cyclohexanesulfonamide?
The IUPAC name of N-(2-cyanopropyl)cyclohexanesulfonamide (CID 62651123) is N-(2-cyanopropyl)cyclohexanesulfonamide.
What is the SMILES notation for N-(2-cyanopropyl)cyclohexanesulfonamide?
The canonical SMILES for N-(2-cyanopropyl)cyclohexanesulfonamide is CC(C#N)CNS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-(2-cyanopropyl)cyclohexanesulfonamide?
The InChIKey is CQZGCUKJKMKXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S/c1-9(7-11)8-12-15(13,14)10-5-3-2-4-6-10/h9-10,12H,2-6,8H2,1H3.
What are the key properties of N-(2-cyanopropyl)cyclohexanesulfonamide?
N-(2-cyanopropyl)cyclohexanesulfonamide has a molecular weight of 230.33 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanopropyl)cyclohexanesulfonamide is sourced from PubChem (CID 62651123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).