(3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol

C14H14FNO3 — CID 79722260

IUPAC(3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
SMILESCOc1ccc(C(O)c2ccc(F)cn2)cc1OC
InChIInChI=1S/C14H14FNO3/c1-18-12-6-3-9(7-13(12)19-2)14(17)11-5-4-10(15)8-16-11/h3-8,14,17H,1-2H3
InChIKeyWWQZJZXUJWUUDL-UHFFFAOYSA-N
MW263.27 g/mol
LogP2.32
Rot. Bonds4

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

(3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol (PubChem CID 79722260) has the molecular formula C14H14FNO3 and a molecular weight of 263.27 g/mol. Its IUPAC name is (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol.

Molecular Properties

Compound Name(3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
PubChem CID79722260
Molecular FormulaC14H14FNO3
Molecular Weight263.27 g/mol
Exact Mass263.10
IUPAC Name(3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
SMILESCOc1ccc(C(O)c2ccc(F)cn2)cc1OC
InChIInChI=1S/C14H14FNO3/c1-18-12-6-3-9(7-13(12)19-2)14(17)11-5-4-10(15)8-16-11/h3-8,14,17H,1-2H3
InChIKeyWWQZJZXUJWUUDL-UHFFFAOYSA-N
XLogP2.32
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-fluoro-2-pyridinyl)-(3-methoxyphenyl)methanol
CID 79723849
(5-fluoro-2-pyridinyl)-(4-propan-2-ylphenyl)methanol
CID 79721925
(5-chloro-2-methoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
CID 79722706
(3,4-dimethoxyphenyl)-pyridin-2-ylmethanol
CID 14098122
(5-fluoro-2-methoxyphenyl)-(5-methyl-2-pyridinyl)methanol
CID 82770681
(3,4-dimethoxyphenyl)-(2-methylpyrimidin-4-yl)methanol
CID 115527861
(S)-(3-fluoro-4-methoxyphenyl)-pyridin-2-ylmethanol
CID 94605505
(S)-(3,4-dimethoxyphenyl)-phenylmethanol
CID 7154230
[(4-chloro-3-methoxyphenyl)-(5-fluoro-2-pyridinyl)methyl]hydrazine
CID 105248290
(5-fluoro-2-pyridinyl)-quinolin-6-ylmethanol
CID 81221058
1-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)ethanol
CID 60797865
1,2-bis(3,4-dimethoxyphenyl)ethane-1,2-diol
CID 11461770

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol?
The IUPAC name of (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol (CID 79722260) is (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol.
What is the SMILES notation for (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol?
The canonical SMILES for (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol is COc1ccc(C(O)c2ccc(F)cn2)cc1OC.
What is the InChIKey of (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol?
The InChIKey is WWQZJZXUJWUUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO3/c1-18-12-6-3-9(7-13(12)19-2)14(17)11-5-4-10(15)8-16-11/h3-8,14,17H,1-2H3.
What are the key properties of (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol?
(3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol has a molecular weight of 263.27 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol is sourced from PubChem (CID 79722260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).