N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride

C5H13ClN2O2S — CID 50988600

IUPACN-(3-aminocyclobutyl)methanesulfonamide;hydrochloride
SMILESCS(=O)(=O)NC1CC(N)C1.Cl
InChIInChI=1S/C5H12N2O2S.ClH/c1-10(8,9)7-5-2-4(6)3-5;/h4-5,7H,2-3,6H2,1H3;1H
InChIKeyDJZXCUJJQUUGNA-UHFFFAOYSA-N
MW200.69 g/mol
LogP-0.55
Rot. Bonds2

About N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride

N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride (PubChem CID 50988600) has the molecular formula C5H13ClN2O2S and a molecular weight of 200.69 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)methanesulfonamide;hydrochloride
PubChem CID50988600
Molecular FormulaC5H13ClN2O2S
Molecular Weight200.69 g/mol
Exact Mass200.04
IUPAC NameN-(3-aminocyclobutyl)methanesulfonamide;hydrochloride
SMILESCS(=O)(=O)NC1CC(N)C1.Cl
InChIInChI=1S/C5H12N2O2S.ClH/c1-10(8,9)7-5-2-4(6)3-5;/h4-5,7H,2-3,6H2,1H3;1H
InChIKeyDJZXCUJJQUUGNA-UHFFFAOYSA-N
XLogP-0.55
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.69
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride?
The IUPAC name of N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride (CID 50988600) is N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride.
What is the SMILES notation for N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride?
The canonical SMILES for N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride is CS(=O)(=O)NC1CC(N)C1.Cl.
What is the InChIKey of N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride?
The InChIKey is DJZXCUJJQUUGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2S.ClH/c1-10(8,9)7-5-2-4(6)3-5;/h4-5,7H,2-3,6H2,1H3;1H.
What are the key properties of N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride?
N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride has a molecular weight of 200.69 g/mol, XLogP of -0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)methanesulfonamide;hydrochloride is sourced from PubChem (CID 50988600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).