6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine

C19H16F2N4 — CID 150594120

IUPAC6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine
SMILESCN1CN(Cc2ccncc2)c2cc(-c3ccc(F)c(F)c3)cnc21
InChIInChI=1S/C19H16F2N4/c1-24-12-25(11-13-4-6-22-7-5-13)18-9-15(10-23-19(18)24)14-2-3-16(20)17(21)8-14/h2-10H,11-12H2,1H3
InChIKeyIQMPFAQNXKUSAA-UHFFFAOYSA-N
MW338.36 g/mol
LogP3.84
Rot. Bonds3

About 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine

6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine (PubChem CID 150594120) has the molecular formula C19H16F2N4 and a molecular weight of 338.36 g/mol. Its IUPAC name is 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine
PubChem CID150594120
Molecular FormulaC19H16F2N4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Name6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine
SMILESCN1CN(Cc2ccncc2)c2cc(-c3ccc(F)c(F)c3)cnc21
InChIInChI=1S/C19H16F2N4/c1-24-12-25(11-13-4-6-22-7-5-13)18-9-15(10-23-19(18)24)14-2-3-16(20)17(21)8-14/h2-10H,11-12H2,1H3
InChIKeyIQMPFAQNXKUSAA-UHFFFAOYSA-N
XLogP3.84
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine (CID 150594120) is 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine is CN1CN(Cc2ccncc2)c2cc(-c3ccc(F)c(F)c3)cnc21.
What is the InChIKey of 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine?
The InChIKey is IQMPFAQNXKUSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4/c1-24-12-25(11-13-4-6-22-7-5-13)18-9-15(10-23-19(18)24)14-2-3-16(20)17(21)8-14/h2-10H,11-12H2,1H3.
What are the key properties of 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine?
6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine has a molecular weight of 338.36 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-difluorophenyl)-3-methyl-1-(pyridin-4-ylmethyl)-2H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 150594120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).