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

C12H17N5O2S — CID 129338525

IUPAC1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)NC[C@H]2CCn3ccnc3C2)cn1
InChIInChI=1S/C12H17N5O2S/c1-16-9-11(8-14-16)20(18,19)15-7-10-2-4-17-5-3-13-12(17)6-10/h3,5,8-10,15H,2,4,6-7H2,1H3/t10-/m0/s1
InChIKeyUPYHHSUZHVXEMN-JTQLQIEISA-N
MW295.37 g/mol
LogP0.16
Rot. Bonds4

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

1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide (PubChem CID 129338525) has the molecular formula C12H17N5O2S and a molecular weight of 295.37 g/mol. Its IUPAC name is 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide
PubChem CID129338525
Molecular FormulaC12H17N5O2S
Molecular Weight295.37 g/mol
Exact Mass295.11
IUPAC Name1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)NC[C@H]2CCn3ccnc3C2)cn1
InChIInChI=1S/C12H17N5O2S/c1-16-9-11(8-14-16)20(18,19)15-7-10-2-4-17-5-3-13-12(17)6-10/h3,5,8-10,15H,2,4,6-7H2,1H3/t10-/m0/s1
InChIKeyUPYHHSUZHVXEMN-JTQLQIEISA-N
XLogP0.16
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-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 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide?
The IUPAC name of 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide (CID 129338525) is 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide.
What is the SMILES notation for 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide?
The canonical SMILES for 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide is Cn1cc(S(=O)(=O)NC[C@H]2CCn3ccnc3C2)cn1.
What is the InChIKey of 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide?
The InChIKey is UPYHHSUZHVXEMN-JTQLQIEISA-N. The full InChI is InChI=1S/C12H17N5O2S/c1-16-9-11(8-14-16)20(18,19)15-7-10-2-4-17-5-3-13-12(17)6-10/h3,5,8-10,15H,2,4,6-7H2,1H3/t10-/m0/s1.
What are the key properties of 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide?
1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide has a molecular weight of 295.37 g/mol, XLogP of 0.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]pyrazole-4-sulfonamide is sourced from PubChem (CID 129338525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).