2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine

C18H13FN4 — CID 117165459

IUPAC2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine
SMILESFc1ccc(Cc2nc3cccnc3n2-c2cccnc2)cc1
InChIInChI=1S/C18H13FN4/c19-14-7-5-13(6-8-14)11-17-22-16-4-2-10-21-18(16)23(17)15-3-1-9-20-12-15/h1-10,12H,11H2
InChIKeyPSSPCBGZMPIQJK-UHFFFAOYSA-N
MW304.33 g/mol
LogP3.55
Rot. Bonds3

About 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine

2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine (PubChem CID 117165459) has the molecular formula C18H13FN4 and a molecular weight of 304.33 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine
PubChem CID117165459
Molecular FormulaC18H13FN4
Molecular Weight304.33 g/mol
Exact Mass304.11
IUPAC Name2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine
SMILESFc1ccc(Cc2nc3cccnc3n2-c2cccnc2)cc1
InChIInChI=1S/C18H13FN4/c19-14-7-5-13(6-8-14)11-17-22-16-4-2-10-21-18(16)23(17)15-3-1-9-20-12-15/h1-10,12H,11H2
InChIKeyPSSPCBGZMPIQJK-UHFFFAOYSA-N
XLogP3.55
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methylphenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine
CID 117165458
2-[(4-methylphenyl)methyl]-3-phenylimidazo[4,5-b]pyridine
CID 117165506
3-ethyl-2-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridine
CID 117165475
2-(chloromethyl)-3-(4-fluorophenyl)imidazo[4,5-b]pyridine
CID 79289700
3-[(3-pyridin-4-ylimidazo[4,5-b]pyridin-2-yl)methyl]phenol
CID 117165156
3-(4-fluorophenyl)-2-methylimidazo[4,5-b]pyridine
CID 14119097
3-(4-fluorophenyl)-2-(oxan-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117161697
2-[(2-fluorophenyl)methyl]-3-(4-methylphenyl)imidazo[4,5-b]pyridine
CID 117165326
N-[(4-fluorophenyl)methyl]-4-[(3-phenylimidazo[4,5-b]pyridin-2-yl)methyl]piperazine-1-carboxamide
CID 50830755
3-[[3-(3-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methyl]phenol
CID 117165093
2-[(3-fluorophenyl)methyl]-3-thiophen-2-ylimidazo[4,5-b]pyridine
CID 117165008
2-benzyl-3-thiophen-2-ylimidazo[4,5-b]pyridine
CID 117164999

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine?
The IUPAC name of 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine (CID 117165459) is 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine is Fc1ccc(Cc2nc3cccnc3n2-c2cccnc2)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine?
The InChIKey is PSSPCBGZMPIQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4/c19-14-7-5-13(6-8-14)11-17-22-16-4-2-10-21-18(16)23(17)15-3-1-9-20-12-15/h1-10,12H,11H2.
What are the key properties of 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine?
2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine has a molecular weight of 304.33 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methyl]-3-pyridin-3-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 117165459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).