3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol

C15H14FN3O — CID 136789728

IUPAC3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCCCn1c(-c2c(O)cccc2F)nc2cccnc21
InChIInChI=1S/C15H14FN3O/c1-2-9-19-14-11(6-4-8-17-14)18-15(19)13-10(16)5-3-7-12(13)20/h3-8,20H,2,9H2,1H3
InChIKeyAQQVUTWDULGDQS-UHFFFAOYSA-N
MW271.30 g/mol
LogP3.35
Rot. Bonds3

About 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol

3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol (PubChem CID 136789728) has the molecular formula C15H14FN3O and a molecular weight of 271.30 g/mol. Its IUPAC name is 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol.

Molecular Properties

Compound Name3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
PubChem CID136789728
Molecular FormulaC15H14FN3O
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC Name3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
SMILESCCCn1c(-c2c(O)cccc2F)nc2cccnc21
InChIInChI=1S/C15H14FN3O/c1-2-9-19-14-11(6-4-8-17-14)18-15(19)13-10(16)5-3-7-12(13)20/h3-8,20H,2,9H2,1H3
InChIKeyAQQVUTWDULGDQS-UHFFFAOYSA-N
XLogP3.35
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-4-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol
CID 136750908
2-(3-cyclopropylimidazo[4,5-b]pyridin-2-yl)-3-fluorophenol
CID 136789732
2-(3-ethylimidazo[4,5-b]pyridin-2-yl)-5-fluorophenol
CID 136789710
2-ethyl-3-propylimidazo[4,5-b]pyridine
CID 20777190
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2,5,6-trifluorophenol
CID 63757477
2-[2-(4-fluorophenyl)imidazo[4,5-b]pyridin-3-yl]ethanamine
CID 53007688
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)phenol
CID 63757136
2-(1-ethyl-5-methylbenzimidazol-2-yl)-3-fluorophenol
CID 136678120
3-fluoro-2-methyl-N-(3-methylbutyl)-N-[(3-propylimidazo[4,5-b]pyridin-2-yl)methyl]benzamide
CID 18733085
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284
N-(4-methylsulfanylphenyl)-3-(3-propylimidazo[4,5-b]pyridin-2-yl)benzamide
CID 53149025
ethyl 2-methyl-2-(3-propylimidazo[4,5-b]pyridin-2-yl)propanoate
CID 79471291

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
The IUPAC name of 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol (CID 136789728) is 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol.
What is the SMILES notation for 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
The canonical SMILES for 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol is CCCn1c(-c2c(O)cccc2F)nc2cccnc21.
What is the InChIKey of 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
The InChIKey is AQQVUTWDULGDQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O/c1-2-9-19-14-11(6-4-8-17-14)18-15(19)13-10(16)5-3-7-12(13)20/h3-8,20H,2,9H2,1H3.
What are the key properties of 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol?
3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol has a molecular weight of 271.30 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-(3-propylimidazo[4,5-b]pyridin-2-yl)phenol is sourced from PubChem (CID 136789728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).