N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride

C12H26ClN3O2S — CID 119986003

IUPACN-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride
SMILESCl.NCC1CCCCC1NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H25N3O2S.ClH/c13-10-11-6-2-3-7-12(11)14-18(16,17)15-8-4-1-5-9-15;/h11-12,14H,1-10,13H2;1H
InChIKeyGCJTUMHYOYMDCO-UHFFFAOYSA-N
MW311.88 g/mol
LogP1.25
Rot. Bonds4

About N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride

N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride (PubChem CID 119986003) has the molecular formula C12H26ClN3O2S and a molecular weight of 311.88 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride
PubChem CID119986003
Molecular FormulaC12H26ClN3O2S
Molecular Weight311.88 g/mol
Exact Mass311.14
IUPAC NameN-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride
SMILESCl.NCC1CCCCC1NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H25N3O2S.ClH/c13-10-11-6-2-3-7-12(11)14-18(16,17)15-8-4-1-5-9-15;/h11-12,14H,1-10,13H2;1H
InChIKeyGCJTUMHYOYMDCO-UHFFFAOYSA-N
XLogP1.25
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.88
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride 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-ethylcyclohexyl)azepane-1-sulfonamide
CID 47030327
N-[2-(aminomethyl)cyclopentyl]-2,6-dimethylmorpholine-4-sulfonamide;hydrochloride
CID 119985507
N-[2-(aminomethyl)cyclopentyl]-3,4-dihydro-1H-isoquinoline-2-sulfonamide;hydrochloride
CID 119985438
1-[[2-(hydroxymethyl)cyclohexyl]sulfamoyl]piperidine-4-carboxylic acid
CID 106359363
2-(piperidin-1-ylsulfonylamino)cyclopentane-1-carbothioamide
CID 62957475
N-cycloheptylpiperidine-1-sulfonamide
CID 110705910
N-[2-(aminomethyl)cyclopentyl]-1-cyclohexylmethanesulfonamide
CID 62955693
[[2-(aminomethyl)cyclopentyl]sulfamoyl-methylamino]cyclohexane;hydrochloride
CID 119985441
N-(2-aminocycloheptyl)morpholine-4-sulfonamide
CID 63258708
N-[2-(aminomethyl)cyclohexyl]-1-ethylsulfonylpiperidine-4-carboxamide;hydrochloride
CID 119612379
2-(aminomethyl)-N-(ethylsulfamoyl)cyclohexan-1-amine
CID 115752499
1-(aminomethyl)-2-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane;hydrochloride
CID 119986092

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride?
The IUPAC name of N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride (CID 119986003) is N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride.
What is the SMILES notation for N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride?
The canonical SMILES for N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride is Cl.NCC1CCCCC1NS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride?
The InChIKey is GCJTUMHYOYMDCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S.ClH/c13-10-11-6-2-3-7-12(11)14-18(16,17)15-8-4-1-5-9-15;/h11-12,14H,1-10,13H2;1H.
What are the key properties of N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride?
N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride has a molecular weight of 311.88 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclohexyl]piperidine-1-sulfonamide;hydrochloride is sourced from PubChem (CID 119986003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).