4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide

C15H18N4O2S — CID 137374322

IUPAC4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide
SMILESNS(=O)(=O)N1CCC(C2c3ccccc3-c3cncn32)CC1
InChIInChI=1S/C15H18N4O2S/c16-22(20,21)18-7-5-11(6-8-18)15-13-4-2-1-3-12(13)14-9-17-10-19(14)15/h1-4,9-11,15H,5-8H2,(H2,16,20,21)
InChIKeyOXWAZOGAVXQWNB-UHFFFAOYSA-N
MW318.40 g/mol
LogP1.37
Rot. Bonds2

About 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide

4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide (PubChem CID 137374322) has the molecular formula C15H18N4O2S and a molecular weight of 318.40 g/mol. Its IUPAC name is 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide
PubChem CID137374322
Molecular FormulaC15H18N4O2S
Molecular Weight318.40 g/mol
Exact Mass318.12
IUPAC Name4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide
SMILESNS(=O)(=O)N1CCC(C2c3ccccc3-c3cncn32)CC1
InChIInChI=1S/C15H18N4O2S/c16-22(20,21)18-7-5-11(6-8-18)15-13-4-2-1-3-12(13)14-9-17-10-19(14)15/h1-4,9-11,15H,5-8H2,(H2,16,20,21)
InChIKeyOXWAZOGAVXQWNB-UHFFFAOYSA-N
XLogP1.37
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-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 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide?
The IUPAC name of 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide (CID 137374322) is 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide.
What is the SMILES notation for 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide?
The canonical SMILES for 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide is NS(=O)(=O)N1CCC(C2c3ccccc3-c3cncn32)CC1.
What is the InChIKey of 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide?
The InChIKey is OXWAZOGAVXQWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2S/c16-22(20,21)18-7-5-11(6-8-18)15-13-4-2-1-3-12(13)14-9-17-10-19(14)15/h1-4,9-11,15H,5-8H2,(H2,16,20,21).
What are the key properties of 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide?
4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide has a molecular weight of 318.40 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5H-imidazo[5,1-a]isoindol-5-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 137374322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).