2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

C24H22F2N8 — CID 146490653

IUPAC2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESCc1cnc2ccc(-c3c(N4CCCC4)nc(N)n4nc(Cc5c(F)cccc5F)nc34)cn12
InChIInChI=1S/C24H22F2N8/c1-14-12-28-20-8-7-15(13-33(14)20)21-22(32-9-2-3-10-32)30-24(27)34-23(21)29-19(31-34)11-16-17(25)5-4-6-18(16)26/h4-8,12-13H,2-3,9-11H2,1H3,(H2,27,30)
InChIKeySYFZVDQFZLHXTD-UHFFFAOYSA-N
MW460.49 g/mol
LogP3.80
Rot. Bonds4

About 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (PubChem CID 146490653) has the molecular formula C24H22F2N8 and a molecular weight of 460.49 g/mol. Its IUPAC name is 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
PubChem CID146490653
Molecular FormulaC24H22F2N8
Molecular Weight460.49 g/mol
Exact Mass460.19
IUPAC Name2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESCc1cnc2ccc(-c3c(N4CCCC4)nc(N)n4nc(Cc5c(F)cccc5F)nc34)cn12
InChIInChI=1S/C24H22F2N8/c1-14-12-28-20-8-7-15(13-33(14)20)21-22(32-9-2-3-10-32)30-24(27)34-23(21)29-19(31-34)11-16-17(25)5-4-6-18(16)26/h4-8,12-13H,2-3,9-11H2,1H3,(H2,27,30)
InChIKeySYFZVDQFZLHXTD-UHFFFAOYSA-N
XLogP3.80
TPSA89.64 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.49
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-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 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (CID 146490653) is 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is Cc1cnc2ccc(-c3c(N4CCCC4)nc(N)n4nc(Cc5c(F)cccc5F)nc34)cn12.
What is the InChIKey of 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The InChIKey is SYFZVDQFZLHXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22F2N8/c1-14-12-28-20-8-7-15(13-33(14)20)21-22(32-9-2-3-10-32)30-24(27)34-23(21)29-19(31-34)11-16-17(25)5-4-6-18(16)26/h4-8,12-13H,2-3,9-11H2,1H3,(H2,27,30).
What are the key properties of 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine has a molecular weight of 460.49 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-difluorophenyl)methyl]-8-(3-methylimidazo[1,2-a]pyridin-6-yl)-7-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 146490653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).