N-(4-aminocyclohexyl)methanesulfonamide

C7H16N2O2S — CID 18348422

IUPACN-(4-aminocyclohexyl)methanesulfonamide
SMILESCS(=O)(=O)NC1CCC(N)CC1
InChIInChI=1S/C7H16N2O2S/c1-12(10,11)9-7-4-2-6(8)3-5-7/h6-7,9H,2-5,8H2,1H3
InChIKeyILBSHRGPVFXDTH-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.19
Rot. Bonds2

About N-(4-aminocyclohexyl)methanesulfonamide

N-(4-aminocyclohexyl)methanesulfonamide (PubChem CID 18348422) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)methanesulfonamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)methanesulfonamide
PubChem CID18348422
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC NameN-(4-aminocyclohexyl)methanesulfonamide
SMILESCS(=O)(=O)NC1CCC(N)CC1
InChIInChI=1S/C7H16N2O2S/c1-12(10,11)9-7-4-2-6(8)3-5-7/h6-7,9H,2-5,8H2,1H3
InChIKeyILBSHRGPVFXDTH-UHFFFAOYSA-N
XLogP-0.19
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-cyclohexylethanesulfonamide
CID 3145398
1-Butanesulfonamide, N-cyclohexyl-
CID 47495
(Methylsulfonyl){4-[(methylsulfonyl)amino]cyclohexyl}amine
CID 1530175
N-(6-aminohexyl)methanesulfonamide
CID 14484867
n-Cyclohexylmethanesulfonamide
CID 230467
N-(4-aminocyclohexyl)methanesulfonamide hydrochloride
CID 54594800
N-((1S,2S)-2-methanesulfonamidocyclohexyl)methanesulfonamide
CID 56972046
rac-N-[(1R,2R)-2-aminocyclohexyl]methanesulfonamide
CID 69344413
Sulfamide, N-cyclohexyl-N'-methyl-
CID 1513138
rac-N-((1R,2R)-2-aminocyclohexyl)methanesulfonamide hydrochloride
CID 137832727
N,N'-((1R,2R)-cyclohexane-1,2-diyl)dimethanesulfonamide
CID 11043842
N-(butylsulfamoyl)cyclohexanamine
CID 15569633

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)methanesulfonamide?
The IUPAC name of N-(4-aminocyclohexyl)methanesulfonamide (CID 18348422) is N-(4-aminocyclohexyl)methanesulfonamide.
What is the SMILES notation for N-(4-aminocyclohexyl)methanesulfonamide?
The canonical SMILES for N-(4-aminocyclohexyl)methanesulfonamide is CS(=O)(=O)NC1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)methanesulfonamide?
The InChIKey is ILBSHRGPVFXDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-12(10,11)9-7-4-2-6(8)3-5-7/h6-7,9H,2-5,8H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)methanesulfonamide?
N-(4-aminocyclohexyl)methanesulfonamide has a molecular weight of 192.28 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)methanesulfonamide is sourced from PubChem (CID 18348422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).