4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide

C15H15ClN4O2S — CID 129338183

IUPAC4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide
SMILESN#Cc1cc(S(=O)(=O)NC[C@@H]2CCc3nccn3C2)ccc1Cl
InChIInChI=1S/C15H15ClN4O2S/c16-14-3-2-13(7-12(14)8-17)23(21,22)19-9-11-1-4-15-18-5-6-20(15)10-11/h2-3,5-7,11,19H,1,4,9-10H2/t11-/m0/s1
InChIKeyUBIDYNHSWUWBTL-NSHDSACASA-N
MW350.83 g/mol
LogP1.95
Rot. Bonds4

About 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide

4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide (PubChem CID 129338183) has the molecular formula C15H15ClN4O2S and a molecular weight of 350.83 g/mol. Its IUPAC name is 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide
PubChem CID129338183
Molecular FormulaC15H15ClN4O2S
Molecular Weight350.83 g/mol
Exact Mass350.06
IUPAC Name4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide
SMILESN#Cc1cc(S(=O)(=O)NC[C@@H]2CCc3nccn3C2)ccc1Cl
InChIInChI=1S/C15H15ClN4O2S/c16-14-3-2-13(7-12(14)8-17)23(21,22)19-9-11-1-4-15-18-5-6-20(15)10-11/h2-3,5-7,11,19H,1,4,9-10H2/t11-/m0/s1
InChIKeyUBIDYNHSWUWBTL-NSHDSACASA-N
XLogP1.95
TPSA87.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.83
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide 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-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide?
The IUPAC name of 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide (CID 129338183) is 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide.
What is the SMILES notation for 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide?
The canonical SMILES for 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide is N#Cc1cc(S(=O)(=O)NC[C@@H]2CCc3nccn3C2)ccc1Cl.
What is the InChIKey of 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide?
The InChIKey is UBIDYNHSWUWBTL-NSHDSACASA-N. The full InChI is InChI=1S/C15H15ClN4O2S/c16-14-3-2-13(7-12(14)8-17)23(21,22)19-9-11-1-4-15-18-5-6-20(15)10-11/h2-3,5-7,11,19H,1,4,9-10H2/t11-/m0/s1.
What are the key properties of 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide?
4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide has a molecular weight of 350.83 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-cyano-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]benzenesulfonamide is sourced from PubChem (CID 129338183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).