2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

C18H17F2N5 — CID 154744117

IUPAC2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESCc1nccc(NC2CCc3nc(-c4ccc(F)cc4F)cn3C2)n1
InChIInChI=1S/C18H17F2N5/c1-11-21-7-6-17(22-11)23-13-3-5-18-24-16(10-25(18)9-13)14-4-2-12(19)8-15(14)20/h2,4,6-8,10,13H,3,5,9H2,1H3,(H,21,22,23)
InChIKeyWYZARQIDTBEMBW-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.35
Rot. Bonds3

About 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (PubChem CID 154744117) has the molecular formula C18H17F2N5 and a molecular weight of 341.37 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
PubChem CID154744117
Molecular FormulaC18H17F2N5
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC Name2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESCc1nccc(NC2CCc3nc(-c4ccc(F)cc4F)cn3C2)n1
InChIInChI=1S/C18H17F2N5/c1-11-21-7-6-17(22-11)23-13-3-5-18-24-16(10-25(18)9-13)14-4-2-12(19)8-15(14)20/h2,4,6-8,10,13H,3,5,9H2,1H3,(H,21,22,23)
InChIKeyWYZARQIDTBEMBW-UHFFFAOYSA-N
XLogP3.35
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (CID 154744117) is 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is Cc1nccc(NC2CCc3nc(-c4ccc(F)cc4F)cn3C2)n1.
What is the InChIKey of 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The InChIKey is WYZARQIDTBEMBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2N5/c1-11-21-7-6-17(22-11)23-13-3-5-18-24-16(10-25(18)9-13)14-4-2-12(19)8-15(14)20/h2,4,6-8,10,13H,3,5,9H2,1H3,(H,21,22,23).
What are the key properties of 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine has a molecular weight of 341.37 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-N-(2-methylpyrimidin-4-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 154744117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).