N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine

C12H27N3O2S — CID 114812942

IUPACN-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NS(=O)(=O)NCC1(CN)CCCCC1
InChIInChI=1S/C12H27N3O2S/c1-11(2,3)15-18(16,17)14-10-12(9-13)7-5-4-6-8-12/h14-15H,4-10,13H2,1-3H3
InChIKeyZOIXOOVZOOLGEL-UHFFFAOYSA-N
MW277.43 g/mol
LogP1.12
Rot. Bonds5

About N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine

N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine (PubChem CID 114812942) has the molecular formula C12H27N3O2S and a molecular weight of 277.43 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine
PubChem CID114812942
Molecular FormulaC12H27N3O2S
Molecular Weight277.43 g/mol
Exact Mass277.18
IUPAC NameN-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NS(=O)(=O)NCC1(CN)CCCCC1
InChIInChI=1S/C12H27N3O2S/c1-11(2,3)15-18(16,17)14-10-12(9-13)7-5-4-6-8-12/h14-15H,4-10,13H2,1-3H3
InChIKeyZOIXOOVZOOLGEL-UHFFFAOYSA-N
XLogP1.12
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.43
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine 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

[1-[(tert-butylsulfamoylamino)methyl]cyclopropyl]methanol
CID 114809734
N-[[1-(aminomethyl)cyclohexyl]methyl]cyclopropanesulfonamide
CID 103970367
N-[[1-(aminomethyl)cyclopentyl]methyl]-2-methylpropane-1-sulfonamide
CID 115365877
N-[[1-(aminomethyl)cyclopropyl]methylsulfamoyl]-2-methoxyethanamine
CID 114816777
N-[[1-(aminomethyl)cycloheptyl]methyl]-2-methylpropan-1-amine
CID 115444997
N-[[1-(aminomethyl)cyclopentyl]methyl]acetamide
CID 115365421
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-methylcyclopentane-1-carboxamide
CID 115365476
N-[[1-(aminomethyl)cyclopentyl]methyl]-3,4-dimethylbenzenesulfonamide
CID 115365882
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-ethylimidazole-4-sulfonamide
CID 103970327
1-[(tert-butylsulfamoylamino)methyl]-4-ethylcyclohexan-1-ol
CID 114809575
1-(aminomethyl)-1-[tert-butylsulfamoyl(ethyl)amino]cyclopentane
CID 114803863
2-[1-(aminomethyl)cyclohexyl]-N-[2-(methanesulfonamido)-2-methylpropyl]acetamide
CID 104678245

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine (CID 114812942) is N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine is CC(C)(C)NS(=O)(=O)NCC1(CN)CCCCC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine?
The InChIKey is ZOIXOOVZOOLGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2S/c1-11(2,3)15-18(16,17)14-10-12(9-13)7-5-4-6-8-12/h14-15H,4-10,13H2,1-3H3.
What are the key properties of N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine?
N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine has a molecular weight of 277.43 g/mol, XLogP of 1.12, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclohexyl]methylsulfamoyl]-2-methylpropan-2-amine is sourced from PubChem (CID 114812942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).