N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide

C13H27N3O2S — CID 43119800

IUPACN-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NC1(CN)CCCCC1
InChIInChI=1S/C13H27N3O2S/c1-12-7-3-6-10-16(12)19(17,18)15-13(11-14)8-4-2-5-9-13/h12,15H,2-11,14H2,1H3
InChIKeyOVUAFVGRWNUKGV-UHFFFAOYSA-N
MW289.44 g/mol
LogP1.36
Rot. Bonds4

About N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide

N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide (PubChem CID 43119800) has the molecular formula C13H27N3O2S and a molecular weight of 289.44 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide
PubChem CID43119800
Molecular FormulaC13H27N3O2S
Molecular Weight289.44 g/mol
Exact Mass289.18
IUPAC NameN-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide
SMILESCC1CCCCN1S(=O)(=O)NC1(CN)CCCCC1
InChIInChI=1S/C13H27N3O2S/c1-12-7-3-6-10-16(12)19(17,18)15-13(11-14)8-4-2-5-9-13/h12,15H,2-11,14H2,1H3
InChIKeyOVUAFVGRWNUKGV-UHFFFAOYSA-N
XLogP1.36
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.44
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide 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

[(2-Amino-2-ethylbutyl)sulfamoyl-methylamino]cyclohexane
CID 86780419
1-Amino-1-[[[ethyl(methyl)sulfamoyl]amino]methyl]cyclohexane
CID 86780507
N-(2-amino-2-ethylbutyl)piperidine-1-sulfonamide
CID 91645913
3,5-dimethyl-N-[3-(trifluoromethyl)cyclohexyl]piperidine-1-sulfonamide
CID 86922602
N-(2,2,2-trifluoroethyl)-1,4-diazaspiro[5.5]undecane-1-sulfonamide
CID 114810921
3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
CID 42894521
N-[(1-piperazin-1-ylcyclohexyl)methyl]methanesulfonamide
CID 59088740
N-[[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl]methanesulfonamide
CID 59088747
4-[2-[Cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine
CID 70551613
4-[2-[[Cyclohexyl(methyl)sulfamoyl]amino]ethyl]piperidine
CID 70585175
N-(2-methylhexan-2-yl)piperidine-1-sulfonamide
CID 138623370
4-[Cyclohexylmethyl(sulfamoyl)amino]piperidine
CID 167049334

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide (CID 43119800) is N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide is CC1CCCCN1S(=O)(=O)NC1(CN)CCCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide?
The InChIKey is OVUAFVGRWNUKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2S/c1-12-7-3-6-10-16(12)19(17,18)15-13(11-14)8-4-2-5-9-13/h12,15H,2-11,14H2,1H3.
What are the key properties of N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide?
N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide has a molecular weight of 289.44 g/mol, XLogP of 1.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclohexyl]-2-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 43119800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).