2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine

C21H17N5 — CID 15995106

IUPAC2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine
SMILESCc1ccc(Nc2c(-c3c[nH]c4ccccc34)nc3cnccn23)cc1
InChIInChI=1S/C21H17N5/c1-14-6-8-15(9-7-14)24-21-20(25-19-13-22-10-11-26(19)21)17-12-23-18-5-3-2-4-16(17)18/h2-13,23-24H,1H3
InChIKeySVTIJIYQIWQVQM-UHFFFAOYSA-N
MW339.40 g/mol
LogP4.93
Rot. Bonds3

About 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine

2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine (PubChem CID 15995106) has the molecular formula C21H17N5 and a molecular weight of 339.40 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine
PubChem CID15995106
Molecular FormulaC21H17N5
Molecular Weight339.40 g/mol
Exact Mass339.15
IUPAC Name2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine
SMILESCc1ccc(Nc2c(-c3c[nH]c4ccccc34)nc3cnccn23)cc1
InChIInChI=1S/C21H17N5/c1-14-6-8-15(9-7-14)24-21-20(25-19-13-22-10-11-26(19)21)17-12-23-18-5-3-2-4-16(17)18/h2-13,23-24H,1H3
InChIKeySVTIJIYQIWQVQM-UHFFFAOYSA-N
XLogP4.93
TPSA58.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine?
The IUPAC name of 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine (CID 15995106) is 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine is Cc1ccc(Nc2c(-c3c[nH]c4ccccc34)nc3cnccn23)cc1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine?
The InChIKey is SVTIJIYQIWQVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N5/c1-14-6-8-15(9-7-14)24-21-20(25-19-13-22-10-11-26(19)21)17-12-23-18-5-3-2-4-16(17)18/h2-13,23-24H,1H3.
What are the key properties of 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine?
2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine has a molecular weight of 339.40 g/mol, XLogP of 4.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyrazin-3-amine is sourced from PubChem (CID 15995106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).