1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol

C9H12FNO2 — CID 63200549

IUPAC1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol
SMILESCOCC(O)Cc1ccc(F)cn1
InChIInChI=1S/C9H12FNO2/c1-13-6-9(12)4-8-3-2-7(10)5-11-8/h2-3,5,9,12H,4,6H2,1H3
InChIKeyIFZIDFKVYFZVNK-UHFFFAOYSA-N
MW185.20 g/mol
LogP0.77
Rot. Bonds4

About 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol

1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol (PubChem CID 63200549) has the molecular formula C9H12FNO2 and a molecular weight of 185.20 g/mol. Its IUPAC name is 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol.

Molecular Properties

Compound Name1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol
PubChem CID63200549
Molecular FormulaC9H12FNO2
Molecular Weight185.20 g/mol
Exact Mass185.09
IUPAC Name1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol
SMILESCOCC(O)Cc1ccc(F)cn1
InChIInChI=1S/C9H12FNO2/c1-13-6-9(12)4-8-3-2-7(10)5-11-8/h2-3,5,9,12H,4,6H2,1H3
InChIKeyIFZIDFKVYFZVNK-UHFFFAOYSA-N
XLogP0.77
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.20
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenoxy)-3-methoxypropan-2-ol
CID 86691234
1-(5-bromo-2-pyridinyl)-5-methoxy-4-methylpentan-2-ol
CID 105126245
1-(5-fluoro-2-pyridinyl)-3-methylbutan-2-amine
CID 63197343
2-(2-chloro-3,3-dimethylbutyl)-5-fluoropyridine
CID 63203074
1-(5-fluoro-2-pyridinyl)-3,3-dimethylbutan-2-amine
CID 63196849
1-(2-bromo-5-fluorophenyl)-3-methoxypropan-2-ol
CID 62608798
6-[[(2-hydroxy-3-methoxypropyl)amino]methyl]pyridin-3-ol
CID 79794461
1-(3,5-difluorophenyl)-3-(5-ethyl-2-pyridinyl)propan-2-ol
CID 79745103
1-cyclopropyl-2-(5-fluoro-2-pyridinyl)-N-methylethanamine
CID 63353175
1-methoxy-3-(1-methylpyrazol-4-yl)propan-2-ol
CID 62127498
1-[5-(trifluoromethyl)-2-pyridinyl]butan-2-ol
CID 63201095
1-(5-methoxy-2-pyridinyl)propan-2-ol
CID 83675700

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol?
The IUPAC name of 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol (CID 63200549) is 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol.
What is the SMILES notation for 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol?
The canonical SMILES for 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol is COCC(O)Cc1ccc(F)cn1.
What is the InChIKey of 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol?
The InChIKey is IFZIDFKVYFZVNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FNO2/c1-13-6-9(12)4-8-3-2-7(10)5-11-8/h2-3,5,9,12H,4,6H2,1H3.
What are the key properties of 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol?
1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol has a molecular weight of 185.20 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-pyridinyl)-3-methoxypropan-2-ol is sourced from PubChem (CID 63200549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).