5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine

C24H23N7 — CID 71153171

IUPAC5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1ncc(C)n2nc(-c3cc4nc(-c5ccccc5)cn4cc3N3CCCC3)nc12
InChIInChI=1S/C24H23N7/c1-16-13-25-17(2)24-27-23(28-31(16)24)19-12-22-26-20(18-8-4-3-5-9-18)14-30(22)15-21(19)29-10-6-7-11-29/h3-5,8-9,12-15H,6-7,10-11H2,1-2H3
InChIKeyHSZGXAXFCXLXRX-UHFFFAOYSA-N
MW409.50 g/mol
LogP4.32
Rot. Bonds3

About 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine

5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 71153171) has the molecular formula C24H23N7 and a molecular weight of 409.50 g/mol. Its IUPAC name is 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID71153171
Molecular FormulaC24H23N7
Molecular Weight409.50 g/mol
Exact Mass409.20
IUPAC Name5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCc1ncc(C)n2nc(-c3cc4nc(-c5ccccc5)cn4cc3N3CCCC3)nc12
InChIInChI=1S/C24H23N7/c1-16-13-25-17(2)24-27-23(28-31(16)24)19-12-22-26-20(18-8-4-3-5-9-18)14-30(22)15-21(19)29-10-6-7-11-29/h3-5,8-9,12-15H,6-7,10-11H2,1-2H3
InChIKeyHSZGXAXFCXLXRX-UHFFFAOYSA-N
XLogP4.32
TPSA63.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.50
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine (CID 71153171) is 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine is Cc1ncc(C)n2nc(-c3cc4nc(-c5ccccc5)cn4cc3N3CCCC3)nc12.
What is the InChIKey of 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is HSZGXAXFCXLXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N7/c1-16-13-25-17(2)24-27-23(28-31(16)24)19-12-22-26-20(18-8-4-3-5-9-18)14-30(22)15-21(19)29-10-6-7-11-29/h3-5,8-9,12-15H,6-7,10-11H2,1-2H3.
What are the key properties of 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine?
5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 409.50 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethyl-2-(2-phenyl-6-pyrrolidin-1-ylimidazo[1,2-a]pyridin-7-yl)-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 71153171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).