(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol

C15H16FNO2 — CID 105124352

IUPAC(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol
SMILESCOc1cc(C)c(C(O)c2cncc(F)c2)cc1C
InChIInChI=1S/C15H16FNO2/c1-9-5-14(19-3)10(2)4-13(9)15(18)11-6-12(16)8-17-7-11/h4-8,15,18H,1-3H3
InChIKeyBOHFSCQBVGBZTH-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.93
Rot. Bonds3

About (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol

(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol (PubChem CID 105124352) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol
PubChem CID105124352
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol
SMILESCOc1cc(C)c(C(O)c2cncc(F)c2)cc1C
InChIInChI=1S/C15H16FNO2/c1-9-5-14(19-3)10(2)4-13(9)15(18)11-6-12(16)8-17-7-11/h4-8,15,18H,1-3H3
InChIKeyBOHFSCQBVGBZTH-UHFFFAOYSA-N
XLogP2.93
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
CID 105066191
(2,3-difluoro-4-methylphenyl)-(5-fluoro-3-pyridinyl)methanol
CID 107516186
(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
(3,4-dimethylphenyl)-(5-fluoro-3-pyridinyl)methanol
CID 63893392
(3,5-difluorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 64990191
(1R)-1-(4-methoxy-2,5-dimethylphenyl)ethanol
CID 93182220
1-(5-fluoro-3-pyridinyl)-1-(3-methoxy-4-methylphenyl)-N-methylmethanamine
CID 115804713
(3,6-dimethylpyridazin-4-yl)-(4-methoxy-2,5-dimethylphenyl)methanol
CID 105124256
(3,5-dimethoxypyrazin-2-yl)-(5-fluoro-3-pyridinyl)methanol
CID 105123520
(5-fluoro-3-pyridinyl)-(3-methylthiophen-2-yl)methanol
CID 63894490
1-(4-methoxy-2,5-dimethylphenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 102923788
(5-fluoro-3-pyridinyl)-(5-methylfuran-2-yl)methanol
CID 63894041

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol?
The IUPAC name of (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol (CID 105124352) is (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol is COc1cc(C)c(C(O)c2cncc(F)c2)cc1C.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol?
The InChIKey is BOHFSCQBVGBZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-9-5-14(19-3)10(2)4-13(9)15(18)11-6-12(16)8-17-7-11/h4-8,15,18H,1-3H3.
What are the key properties of (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol?
(5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol has a molecular weight of 261.30 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(4-methoxy-2,5-dimethylphenyl)methanol is sourced from PubChem (CID 105124352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).