N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine

C13H27N3O2S — CID 114810365

IUPACN-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine
SMILESCCCNS(=O)(=O)NC1CCNC2(CCCCC2)C1
InChIInChI=1S/C13H27N3O2S/c1-2-9-15-19(17,18)16-12-6-10-14-13(11-12)7-4-3-5-8-13/h12,14-16H,2-11H2,1H3
InChIKeyCALHXJKFIDIOGQ-UHFFFAOYSA-N
MW289.44 g/mol
LogP1.28
Rot. Bonds5

About N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine

N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine (PubChem CID 114810365) has the molecular formula C13H27N3O2S and a molecular weight of 289.44 g/mol. Its IUPAC name is N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine.

Molecular Properties

Compound NameN-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine
PubChem CID114810365
Molecular FormulaC13H27N3O2S
Molecular Weight289.44 g/mol
Exact Mass289.18
IUPAC NameN-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine
SMILESCCCNS(=O)(=O)NC1CCNC2(CCCCC2)C1
InChIInChI=1S/C13H27N3O2S/c1-2-9-15-19(17,18)16-12-6-10-14-13(11-12)7-4-3-5-8-13/h12,14-16H,2-11H2,1H3
InChIKeyCALHXJKFIDIOGQ-UHFFFAOYSA-N
XLogP1.28
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.44
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-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-Azaspiro(5.5)undecan-4-amine
CID 64981405
3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-sulfonamide
CID 91642856
4-[(4,4-Difluorocyclohexyl)methyl-sulfamoylamino]piperidine
CID 167049362
N-(1-azaspiro[5.5]undecan-4-yl)-1,1,1-trifluoromethanesulfonamide
CID 43598115
N-(2,2,2-trifluoroethylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine
CID 114810366
3-methyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
CID 42894521
2,2,6,6-Tetramethyl-4-(sulfinatoamino)piperidine
CID 17912142
2-(1-Piperidin-4-ylpropyl)-1,2,6-thiadiazinane 1,1-dioxide
CID 20434924
(1S)-1-cyclohexyl-N'-(dimethylsulfamoyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 58821835
4-[2-[Cyclohexylsulfamoyl(methyl)amino]ethyl]piperidine
CID 70551613
4-[2-[[Cyclohexyl(methyl)sulfamoyl]amino]ethyl]piperidine
CID 70585175
4-Ethyl-2-methyl-3-(3-methylbutyl)-1,2,6-thiadiazinane 1,1-dioxide
CID 118241953

Frequently Asked Questions

What is the IUPAC name of N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine?
The IUPAC name of N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine (CID 114810365) is N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine.
What is the SMILES notation for N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine?
The canonical SMILES for N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine is CCCNS(=O)(=O)NC1CCNC2(CCCCC2)C1.
What is the InChIKey of N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine?
The InChIKey is CALHXJKFIDIOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2S/c1-2-9-15-19(17,18)16-12-6-10-14-13(11-12)7-4-3-5-8-13/h12,14-16H,2-11H2,1H3.
What are the key properties of N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine?
N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine has a molecular weight of 289.44 g/mol, XLogP of 1.28, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(propylsulfamoyl)-1-azaspiro[5.5]undecan-4-amine is sourced from PubChem (CID 114810365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).