2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine

C12H8F2N4 — CID 79821482

IUPAC2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESNc1ccc2[nH]c(-c3cc(F)cc(F)c3)nc2n1
InChIInChI=1S/C12H8F2N4/c13-7-3-6(4-8(14)5-7)11-16-9-1-2-10(15)17-12(9)18-11/h1-5H,(H3,15,16,17,18)
InChIKeyPGJLPLJOXYFKLZ-UHFFFAOYSA-N
MW246.22 g/mol
LogP2.49
Rot. Bonds1

About 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine

2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821482) has the molecular formula C12H8F2N4 and a molecular weight of 246.22 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821482
Molecular FormulaC12H8F2N4
Molecular Weight246.22 g/mol
Exact Mass246.07
IUPAC Name2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESNc1ccc2[nH]c(-c3cc(F)cc(F)c3)nc2n1
InChIInChI=1S/C12H8F2N4/c13-7-3-6(4-8(14)5-7)11-16-9-1-2-10(15)17-12(9)18-11/h1-5H,(H3,15,16,17,18)
InChIKeyPGJLPLJOXYFKLZ-UHFFFAOYSA-N
XLogP2.49
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.22
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821482) is 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine is Nc1ccc2[nH]c(-c3cc(F)cc(F)c3)nc2n1.
What is the InChIKey of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is PGJLPLJOXYFKLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N4/c13-7-3-6(4-8(14)5-7)11-16-9-1-2-10(15)17-12(9)18-11/h1-5H,(H3,15,16,17,18).
What are the key properties of 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine?
2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 246.22 g/mol, XLogP of 2.49, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).