N-[(2-methylcyclopropyl)methyl]methanesulfonamide

C6H13NO2S — CID 115581733

IUPACN-[(2-methylcyclopropyl)methyl]methanesulfonamide
SMILESCC1CC1CNS(C)(=O)=O
InChIInChI=1S/C6H13NO2S/c1-5-3-6(5)4-7-10(2,8)9/h5-7H,3-4H2,1-2H3
InChIKeySVIOMHWHGVAYQD-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.19
Rot. Bonds3

About N-[(2-methylcyclopropyl)methyl]methanesulfonamide

N-[(2-methylcyclopropyl)methyl]methanesulfonamide (PubChem CID 115581733) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is N-[(2-methylcyclopropyl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(2-methylcyclopropyl)methyl]methanesulfonamide
PubChem CID115581733
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC NameN-[(2-methylcyclopropyl)methyl]methanesulfonamide
SMILESCC1CC1CNS(C)(=O)=O
InChIInChI=1S/C6H13NO2S/c1-5-3-6(5)4-7-10(2,8)9/h5-7H,3-4H2,1-2H3
InChIKeySVIOMHWHGVAYQD-UHFFFAOYSA-N
XLogP0.19
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-methylcyclopropyl)methyl]methanesulfonamide 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-[(2-methylcyclopropyl)methyl]methanesulfonamide?
The IUPAC name of N-[(2-methylcyclopropyl)methyl]methanesulfonamide (CID 115581733) is N-[(2-methylcyclopropyl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(2-methylcyclopropyl)methyl]methanesulfonamide?
The canonical SMILES for N-[(2-methylcyclopropyl)methyl]methanesulfonamide is CC1CC1CNS(C)(=O)=O.
What is the InChIKey of N-[(2-methylcyclopropyl)methyl]methanesulfonamide?
The InChIKey is SVIOMHWHGVAYQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c1-5-3-6(5)4-7-10(2,8)9/h5-7H,3-4H2,1-2H3.
What are the key properties of N-[(2-methylcyclopropyl)methyl]methanesulfonamide?
N-[(2-methylcyclopropyl)methyl]methanesulfonamide has a molecular weight of 163.24 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylcyclopropyl)methyl]methanesulfonamide is sourced from PubChem (CID 115581733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).