N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide

C8H16N2O6S3 — CID 139495075

IUPACN-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide
SMILESCS(=O)(=O)C1CC1CS(=O)(=O)NS(=O)(=O)N1CCC1
InChIInChI=1S/C8H16N2O6S3/c1-17(11,12)8-5-7(8)6-18(13,14)9-19(15,16)10-3-2-4-10/h7-9H,2-6H2,1H3
InChIKeyZGFUHHBTNVUGRJ-UHFFFAOYSA-N
MW332.43 g/mol
LogP-1.71
Rot. Bonds6

About N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide

N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide (PubChem CID 139495075) has the molecular formula C8H16N2O6S3 and a molecular weight of 332.43 g/mol. Its IUPAC name is N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide.

Molecular Properties

Compound NameN-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide
PubChem CID139495075
Molecular FormulaC8H16N2O6S3
Molecular Weight332.43 g/mol
Exact Mass332.02
IUPAC NameN-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide
SMILESCS(=O)(=O)C1CC1CS(=O)(=O)NS(=O)(=O)N1CCC1
InChIInChI=1S/C8H16N2O6S3/c1-17(11,12)8-5-7(8)6-18(13,14)9-19(15,16)10-3-2-4-10/h7-9H,2-6H2,1H3
InChIKeyZGFUHHBTNVUGRJ-UHFFFAOYSA-N
XLogP-1.71
TPSA117.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 5-1.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-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

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide?
The IUPAC name of N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide (CID 139495075) is N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide.
What is the SMILES notation for N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide?
The canonical SMILES for N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide is CS(=O)(=O)C1CC1CS(=O)(=O)NS(=O)(=O)N1CCC1.
What is the InChIKey of N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide?
The InChIKey is ZGFUHHBTNVUGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O6S3/c1-17(11,12)8-5-7(8)6-18(13,14)9-19(15,16)10-3-2-4-10/h7-9H,2-6H2,1H3.
What are the key properties of N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide?
N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide has a molecular weight of 332.43 g/mol, XLogP of -1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylsulfonylcyclopropyl)methylsulfonyl]azetidine-1-sulfonamide is sourced from PubChem (CID 139495075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).