3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine

C17H16N6O2S — CID 16666225

IUPAC3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCn1cc(-c2cnc3c(Nc4ccc(S(C)(=O)=O)cc4)nccn23)cn1
InChIInChI=1S/C17H16N6O2S/c1-22-11-12(9-20-22)15-10-19-17-16(18-7-8-23(15)17)21-13-3-5-14(6-4-13)26(2,24)25/h3-11H,1-2H3,(H,18,21)
InChIKeyZXQRGHXNCAGOPZ-UHFFFAOYSA-N
MW368.42 g/mol
LogP2.28
Rot. Bonds4

About 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine

3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 16666225) has the molecular formula C17H16N6O2S and a molecular weight of 368.42 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID16666225
Molecular FormulaC17H16N6O2S
Molecular Weight368.42 g/mol
Exact Mass368.11
IUPAC Name3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCn1cc(-c2cnc3c(Nc4ccc(S(C)(=O)=O)cc4)nccn23)cn1
InChIInChI=1S/C17H16N6O2S/c1-22-11-12(9-20-22)15-10-19-17-16(18-7-8-23(15)17)21-13-3-5-14(6-4-13)26(2,24)25/h3-11H,1-2H3,(H,18,21)
InChIKeyZXQRGHXNCAGOPZ-UHFFFAOYSA-N
XLogP2.28
TPSA94.18 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.42
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine 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 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine (CID 16666225) is 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine is Cn1cc(-c2cnc3c(Nc4ccc(S(C)(=O)=O)cc4)nccn23)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is ZXQRGHXNCAGOPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6O2S/c1-22-11-12(9-20-22)15-10-19-17-16(18-7-8-23(15)17)21-13-3-5-14(6-4-13)26(2,24)25/h3-11H,1-2H3,(H,18,21).
What are the key properties of 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine?
3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 368.42 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-N-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 16666225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).