3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol

C15H13ClFN3O — CID 94757538

IUPAC3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
SMILESOCCCn1c(-c2ccccc2F)nc2cc(Cl)cnc21
InChIInChI=1S/C15H13ClFN3O/c16-10-8-13-15(18-9-10)20(6-3-7-21)14(19-13)11-4-1-2-5-12(11)17/h1-2,4-5,8-9,21H,3,6-7H2
InChIKeyAFRWWNUMEXZJKI-UHFFFAOYSA-N
MW305.74 g/mol
LogP3.27
Rot. Bonds4

About 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol

3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol (PubChem CID 94757538) has the molecular formula C15H13ClFN3O and a molecular weight of 305.74 g/mol. Its IUPAC name is 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol.

Molecular Properties

Compound Name3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
PubChem CID94757538
Molecular FormulaC15H13ClFN3O
Molecular Weight305.74 g/mol
Exact Mass305.07
IUPAC Name3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
SMILESOCCCn1c(-c2ccccc2F)nc2cc(Cl)cnc21
InChIInChI=1S/C15H13ClFN3O/c16-10-8-13-15(18-9-10)20(6-3-7-21)14(19-13)11-4-1-2-5-12(11)17/h1-2,4-5,8-9,21H,3,6-7H2
InChIKeyAFRWWNUMEXZJKI-UHFFFAOYSA-N
XLogP3.27
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.74
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[6-chloro-2-(2-methoxyphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 94757541
2-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]acetic acid
CID 93209836
3-[6-chloro-2-(4-methylphenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 82150963
2-[6-chloro-2-(3-methylphenyl)imidazo[4,5-b]pyridin-3-yl]ethanol
CID 82150810
2-[2-(2-fluorophenyl)-6-methylimidazo[4,5-b]pyridin-3-yl]acetic acid
CID 82061424
3-[2-(2-fluorophenyl)-6,7-dihydro-[1,4]dioxino[2,3-f]benzimidazol-3-yl]propan-1-ol
CID 82149624
2-(2-benzyl-6-chloroimidazo[4,5-b]pyridin-3-yl)ethanol
CID 82150820
3-benzyl-6-chloro-2-methylimidazo[4,5-b]pyridine
CID 135336062
2-[6-chloro-2-(3-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]acetic acid
CID 93209838
3-[6-chloro-2-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-3-yl]propan-1-amine
CID 93209804
2-(2-fluorophenyl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
CID 67981840
3-(6-chloro-2-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)propanethioamide
CID 94757877

Frequently Asked Questions

What is the IUPAC name of 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
The IUPAC name of 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol (CID 94757538) is 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol.
What is the SMILES notation for 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
The canonical SMILES for 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol is OCCCn1c(-c2ccccc2F)nc2cc(Cl)cnc21.
What is the InChIKey of 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
The InChIKey is AFRWWNUMEXZJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFN3O/c16-10-8-13-15(18-9-10)20(6-3-7-21)14(19-13)11-4-1-2-5-12(11)17/h1-2,4-5,8-9,21H,3,6-7H2.
What are the key properties of 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol?
3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol has a molecular weight of 305.74 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-chloro-2-(2-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol is sourced from PubChem (CID 94757538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).