(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol

C12H11FN2O2 — CID 105066191

IUPAC(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
SMILESCOc1cnccc1C(O)c1cncc(F)c1
InChIInChI=1S/C12H11FN2O2/c1-17-11-7-14-3-2-10(11)12(16)8-4-9(13)6-15-5-8/h2-7,12,16H,1H3
InChIKeyCHSZDQRSGUROOJ-UHFFFAOYSA-N
MW234.23 g/mol
LogP1.71
Rot. Bonds3

About (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol

(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol (PubChem CID 105066191) has the molecular formula C12H11FN2O2 and a molecular weight of 234.23 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
PubChem CID105066191
Molecular FormulaC12H11FN2O2
Molecular Weight234.23 g/mol
Exact Mass234.08
IUPAC Name(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
SMILESCOc1cnccc1C(O)c1cncc(F)c1
InChIInChI=1S/C12H11FN2O2/c1-17-11-7-14-3-2-10(11)12(16)8-4-9(13)6-15-5-8/h2-7,12,16H,1H3
InChIKeyCHSZDQRSGUROOJ-UHFFFAOYSA-N
XLogP1.71
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol
CID 105066374
(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol
CID 105124352
[3-fluoro-4-(trifluoromethyl)phenyl]-(3-methoxy-4-pyridinyl)methanol
CID 107292052
(4-tert-butylphenyl)-(3-methoxy-4-pyridinyl)methanol
CID 105066253
(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
(3-methoxy-4-pyridinyl)-[3-(trifluoromethoxy)phenyl]methanol
CID 105066282
(2,3-difluoro-4-methylphenyl)-(5-fluoro-3-pyridinyl)methanol
CID 107516186
1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
CID 105065221
(3-methoxy-4-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105066395
(3,4-dimethylphenyl)-(5-fluoro-3-pyridinyl)methanol
CID 63893392
(3-fluoro-4-pyridinyl)-(2,4,5-trimethoxyphenyl)methanol
CID 104737555
(3-methoxy-2-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
CID 114054869

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol?
The IUPAC name of (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol (CID 105066191) is (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol is COc1cnccc1C(O)c1cncc(F)c1.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol?
The InChIKey is CHSZDQRSGUROOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O2/c1-17-11-7-14-3-2-10(11)12(16)8-4-9(13)6-15-5-8/h2-7,12,16H,1H3.
What are the key properties of (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol?
(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol has a molecular weight of 234.23 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol is sourced from PubChem (CID 105066191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).