N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide

C15H23N5O2S — CID 129337018

IUPACN-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide
SMILESCC(C)n1cnc(S(=O)(=O)N(C)C[C@@H]2CCc3nccn3C2)c1
InChIInChI=1S/C15H23N5O2S/c1-12(2)20-10-15(17-11-20)23(21,22)18(3)8-13-4-5-14-16-6-7-19(14)9-13/h6-7,10-13H,4-5,8-9H2,1-3H3/t13-/m0/s1
InChIKeyRPEBKBVCWQXHMD-ZDUSSCGKSA-N
MW337.45 g/mol
LogP1.54
Rot. Bonds5

About N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide

N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide (PubChem CID 129337018) has the molecular formula C15H23N5O2S and a molecular weight of 337.45 g/mol. Its IUPAC name is N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide.

Molecular Properties

Compound NameN-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide
PubChem CID129337018
Molecular FormulaC15H23N5O2S
Molecular Weight337.45 g/mol
Exact Mass337.16
IUPAC NameN-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide
SMILESCC(C)n1cnc(S(=O)(=O)N(C)C[C@@H]2CCc3nccn3C2)c1
InChIInChI=1S/C15H23N5O2S/c1-12(2)20-10-15(17-11-20)23(21,22)18(3)8-13-4-5-14-16-6-7-19(14)9-13/h6-7,10-13H,4-5,8-9H2,1-3H3/t13-/m0/s1
InChIKeyRPEBKBVCWQXHMD-ZDUSSCGKSA-N
XLogP1.54
TPSA73.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-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-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide?
The IUPAC name of N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide (CID 129337018) is N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide.
What is the SMILES notation for N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide?
The canonical SMILES for N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide is CC(C)n1cnc(S(=O)(=O)N(C)C[C@@H]2CCc3nccn3C2)c1.
What is the InChIKey of N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide?
The InChIKey is RPEBKBVCWQXHMD-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H23N5O2S/c1-12(2)20-10-15(17-11-20)23(21,22)18(3)8-13-4-5-14-16-6-7-19(14)9-13/h6-7,10-13H,4-5,8-9H2,1-3H3/t13-/m0/s1.
What are the key properties of N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide?
N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide has a molecular weight of 337.45 g/mol, XLogP of 1.54, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-propan-2-yl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]imidazole-4-sulfonamide is sourced from PubChem (CID 129337018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).