2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine

C13H9F2N3 — CID 63724692

IUPAC2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccnc2nc(-c3ccc(F)c(F)c3)[nH]c12
InChIInChI=1S/C13H9F2N3/c1-7-4-5-16-13-11(7)17-12(18-13)8-2-3-9(14)10(15)6-8/h2-6H,1H3,(H,16,17,18)
InChIKeySXZWJYZGPKDCLM-UHFFFAOYSA-N
MW245.23 g/mol
LogP3.21
Rot. Bonds1

About 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine

2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine (PubChem CID 63724692) has the molecular formula C13H9F2N3 and a molecular weight of 245.23 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine
PubChem CID63724692
Molecular FormulaC13H9F2N3
Molecular Weight245.23 g/mol
Exact Mass245.08
IUPAC Name2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine
SMILESCc1ccnc2nc(-c3ccc(F)c(F)c3)[nH]c12
InChIInChI=1S/C13H9F2N3/c1-7-4-5-16-13-11(7)17-12(18-13)8-2-3-9(14)10(15)6-8/h2-6H,1H3,(H,16,17,18)
InChIKeySXZWJYZGPKDCLM-UHFFFAOYSA-N
XLogP3.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.23
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine (CID 63724692) is 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine is Cc1ccnc2nc(-c3ccc(F)c(F)c3)[nH]c12.
What is the InChIKey of 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine?
The InChIKey is SXZWJYZGPKDCLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2N3/c1-7-4-5-16-13-11(7)17-12(18-13)8-2-3-9(14)10(15)6-8/h2-6H,1H3,(H,16,17,18).
What are the key properties of 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine?
2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine has a molecular weight of 245.23 g/mol, XLogP of 3.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-7-methyl-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 63724692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).