N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide

C10H18N2O3S — CID 71785465

IUPACN-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide
SMILESCS(=O)(=O)N1CC(C(=O)NC2CCCC2)C1
InChIInChI=1S/C10H18N2O3S/c1-16(14,15)12-6-8(7-12)10(13)11-9-4-2-3-5-9/h8-9H,2-7H2,1H3,(H,11,13)
InChIKeyGKYHPXLVEGQNRT-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.06
Rot. Bonds3

About N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide

N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide (PubChem CID 71785465) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide
PubChem CID71785465
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC NameN-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide
SMILESCS(=O)(=O)N1CC(C(=O)NC2CCCC2)C1
InChIInChI=1S/C10H18N2O3S/c1-16(14,15)12-6-8(7-12)10(13)11-9-4-2-3-5-9/h8-9H,2-7H2,1H3,(H,11,13)
InChIKeyGKYHPXLVEGQNRT-UHFFFAOYSA-N
XLogP-0.06
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide 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-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide (CID 71785465) is N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide is CS(=O)(=O)N1CC(C(=O)NC2CCCC2)C1.
What is the InChIKey of N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide?
The InChIKey is GKYHPXLVEGQNRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c1-16(14,15)12-6-8(7-12)10(13)11-9-4-2-3-5-9/h8-9H,2-7H2,1H3,(H,11,13).
What are the key properties of N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide?
N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide has a molecular weight of 246.33 g/mol, XLogP of -0.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-methylsulfonylazetidine-3-carboxamide is sourced from PubChem (CID 71785465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).