(3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol

C15H16FNO2 — CID 82807289

IUPAC(3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol
SMILESCCc1cnccc1C(O)c1cccc(OC)c1F
InChIInChI=1S/C15H16FNO2/c1-3-10-9-17-8-7-11(10)15(18)12-5-4-6-13(19-2)14(12)16/h4-9,15,18H,3H2,1-2H3
InChIKeyNFYSUWVFMYJXPV-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.87
Rot. Bonds4

About (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol

(3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol (PubChem CID 82807289) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol
PubChem CID82807289
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name(3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol
SMILESCCc1cnccc1C(O)c1cccc(OC)c1F
InChIInChI=1S/C15H16FNO2/c1-3-10-9-17-8-7-11(10)15(18)12-5-4-6-13(19-2)14(12)16/h4-9,15,18H,3H2,1-2H3
InChIKeyNFYSUWVFMYJXPV-UHFFFAOYSA-N
XLogP2.87
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 105120947
(2,3-difluoro-4-methylphenyl)-(3-ethyl-4-pyridinyl)methanol
CID 107512987
(2,3-dimethoxyphenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82791266
(2-amino-3-methoxyphenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 107469597
(2-aminophenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82807791
(3-ethyl-4-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103433219
(2,3-dimethylphenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82806744
1-(2-fluoro-3-methoxyphenyl)pentane-1,2-diol
CID 103454923
isoquinolin-8-yl-(3-methoxy-4-pyridinyl)methanol
CID 103139118
[(2-fluoro-3-methoxyphenyl)-(3-methyl-4-pyridinyl)methyl]hydrazine
CID 105261827
1-(2-fluoro-3-methoxyphenyl)propane-1,2,3-triol
CID 170819054
2-(2-fluoro-3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanone
CID 105065080

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol?
The IUPAC name of (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol (CID 82807289) is (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol.
What is the SMILES notation for (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol?
The canonical SMILES for (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol is CCc1cnccc1C(O)c1cccc(OC)c1F.
What is the InChIKey of (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol?
The InChIKey is NFYSUWVFMYJXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-3-10-9-17-8-7-11(10)15(18)12-5-4-6-13(19-2)14(12)16/h4-9,15,18H,3H2,1-2H3.
What are the key properties of (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol?
(3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol has a molecular weight of 261.30 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-4-pyridinyl)-(2-fluoro-3-methoxyphenyl)methanol is sourced from PubChem (CID 82807289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).