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

C18H13FN4 — CID 117164729

IUPAC3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine
SMILESFc1cccc(Cn2c(-c3cccnc3)nc3cccnc32)c1
InChIInChI=1S/C18H13FN4/c19-15-6-1-4-13(10-15)12-23-17(14-5-2-8-20-11-14)22-16-7-3-9-21-18(16)23/h1-11H,12H2
InChIKeyNXKWGOFQHHXNNP-UHFFFAOYSA-N
MW304.33 g/mol
LogP3.68
Rot. Bonds3

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

3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine (PubChem CID 117164729) has the molecular formula C18H13FN4 and a molecular weight of 304.33 g/mol. Its IUPAC name is 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine
PubChem CID117164729
Molecular FormulaC18H13FN4
Molecular Weight304.33 g/mol
Exact Mass304.11
IUPAC Name3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine
SMILESFc1cccc(Cn2c(-c3cccnc3)nc3cccnc32)c1
InChIInChI=1S/C18H13FN4/c19-15-6-1-4-13(10-15)12-23-17(14-5-2-8-20-11-14)22-16-7-3-9-21-18(16)23/h1-11H,12H2
InChIKeyNXKWGOFQHHXNNP-UHFFFAOYSA-N
XLogP3.68
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 ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3-fluorophenyl)methyl]-2-thiophen-2-ylimidazo[4,5-b]pyridine
CID 117164454
3-[(3-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 79289581
2-(chloromethyl)-3-[(3-fluorophenyl)methyl]imidazo[4,5-b]pyridine
CID 71648916
3-(2-methylpropyl)-2-pyridin-3-ylimidazo[4,5-b]pyridine
CID 117164742
2-(3-fluorophenyl)-N-[2-(2-phenylimidazo[4,5-b]pyridin-3-yl)ethyl]acetamide
CID 53020252
3-[(3-fluorophenyl)methyl]-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]imidazo[4,5-b]pyridine
CID 20908726
3-[(3-fluorophenyl)methyl]-2-piperidin-3-ylimidazo[4,5-b]pyridine
CID 117161994
2-(3-fluorophenyl)-3-(oxolan-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117166729
3-[(3-methoxyphenyl)methyl]-2-methylimidazo[4,5-b]pyridine
CID 117166254
3-[(3-fluorophenyl)methyl]-6-methylimidazo[4,5-b]pyridin-2-amine
CID 79300822
[1-[(3-fluorophenyl)methyl]-5-pyridin-3-yltriazol-4-yl]methanol
CID 82211803
[1-[(3-fluorophenyl)methyl]-5-pyridin-3-yltriazol-4-yl]methanamine
CID 82211840

Frequently Asked Questions

What is the IUPAC name of 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine?
The IUPAC name of 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine (CID 117164729) is 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine is Fc1cccc(Cn2c(-c3cccnc3)nc3cccnc32)c1.
What is the InChIKey of 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine?
The InChIKey is NXKWGOFQHHXNNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4/c19-15-6-1-4-13(10-15)12-23-17(14-5-2-8-20-11-14)22-16-7-3-9-21-18(16)23/h1-11H,12H2.
What are the key properties of 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine?
3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine has a molecular weight of 304.33 g/mol, XLogP of 3.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-fluorophenyl)methyl]-2-pyridin-3-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 117164729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).