1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol

C9H12FNO2 — CID 130506809

IUPAC1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol
SMILESCCC(O)c1ccnc(OC)c1F
InChIInChI=1S/C9H12FNO2/c1-3-7(12)6-4-5-11-9(13-2)8(6)10/h4-5,7,12H,3H2,1-2H3
InChIKeyIIGDDYHFODBQJE-UHFFFAOYSA-N
MW185.20 g/mol
LogP1.67
Rot. Bonds3

About 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol

1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol (PubChem CID 130506809) has the molecular formula C9H12FNO2 and a molecular weight of 185.20 g/mol. Its IUPAC name is 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol.

Molecular Properties

Compound Name1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol
PubChem CID130506809
Molecular FormulaC9H12FNO2
Molecular Weight185.20 g/mol
Exact Mass185.09
IUPAC Name1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol
SMILESCCC(O)c1ccnc(OC)c1F
InChIInChI=1S/C9H12FNO2/c1-3-7(12)6-4-5-11-9(13-2)8(6)10/h4-5,7,12H,3H2,1-2H3
InChIKeyIIGDDYHFODBQJE-UHFFFAOYSA-N
XLogP1.67
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.20
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethoxy-3-fluoro-4-pyridinyl)hexan-1-ol
CID 114270275
2-ethoxy-1-(2-ethoxy-3-fluoro-4-pyridinyl)propan-1-ol
CID 114270345
(1,5-dimethylpyrazol-4-yl)-(3-fluoro-2-methoxy-4-pyridinyl)methanol
CID 114270280
(1S)-1-(2-fluoro-3-pyridinyl)propan-1-ol
CID 130786152
2-bicyclo[2.2.1]heptanyl-(3-fluoro-2-methoxy-4-pyridinyl)methanol
CID 114270352
1-(2-fluoro-3-methylphenyl)propan-1-ol
CID 115787793
1-[3-(methoxymethoxy)-4-pyridinyl]propan-1-ol
CID 174389352
(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
CID 79002413
1-[2-(3,3-dimethylbutoxy)-3-fluoro-4-pyridinyl]-2,2-dimethylpropan-1-ol
CID 155439102
2-ethoxy-3-fluoro-4-methylpyridine
CID 88977176
(4-fluoro-2-methoxy-3-pyridinyl)methanol
CID 131145721
[(2-ethyl-5-methylpyrazol-3-yl)-(3-fluoro-2-methoxy-4-pyridinyl)methyl]hydrazine
CID 114270797

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol?
The IUPAC name of 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol (CID 130506809) is 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol.
What is the SMILES notation for 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol?
The canonical SMILES for 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol is CCC(O)c1ccnc(OC)c1F.
What is the InChIKey of 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol?
The InChIKey is IIGDDYHFODBQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12FNO2/c1-3-7(12)6-4-5-11-9(13-2)8(6)10/h4-5,7,12H,3H2,1-2H3.
What are the key properties of 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol?
1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol has a molecular weight of 185.20 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol is sourced from PubChem (CID 130506809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).