(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol

C13H13FN2O3 — CID 103395508

IUPAC(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCOc1ccc(C(O)c2cc(OC)ncn2)c(F)c1
InChIInChI=1S/C13H13FN2O3/c1-18-8-3-4-9(10(14)5-8)13(17)11-6-12(19-2)16-7-15-11/h3-7,13,17H,1-2H3
InChIKeyTZWGEVWLHVEFRS-UHFFFAOYSA-N
MW264.26 g/mol
LogP1.71
Rot. Bonds4

About (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol

(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol (PubChem CID 103395508) has the molecular formula C13H13FN2O3 and a molecular weight of 264.26 g/mol. Its IUPAC name is (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol.

Molecular Properties

Compound Name(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
PubChem CID103395508
Molecular FormulaC13H13FN2O3
Molecular Weight264.26 g/mol
Exact Mass264.09
IUPAC Name(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCOc1ccc(C(O)c2cc(OC)ncn2)c(F)c1
InChIInChI=1S/C13H13FN2O3/c1-18-8-3-4-9(10(14)5-8)13(17)11-6-12(19-2)16-7-15-11/h3-7,13,17H,1-2H3
InChIKeyTZWGEVWLHVEFRS-UHFFFAOYSA-N
XLogP1.71
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.26
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-fluorophenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950386
bis(2-fluoro-4-methoxyphenyl)methanol
CID 102884350
(2-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950226
1-(2-fluoro-4-methoxyphenyl)-2-(6-methoxypyrimidin-4-yl)ethanamine
CID 102883534
(2,4-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61080731
(3,5-difluorophenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61083265
(2-fluoro-4-methoxyphenyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106680266
(2-fluoro-4-methoxyphenyl)-pyrimidin-4-ylmethanamine
CID 103395544
(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950306
(2-fluoro-4-methoxyphenyl)-(6-methoxypyridazin-3-yl)methanamine
CID 103395933
(2-fluoro-4-methoxyphenyl)-(2,3,5,6-tetramethylphenyl)methanol
CID 102884337
(2-fluoro-4-methoxyphenyl)-pyridazin-4-ylmethanol
CID 103397496

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The IUPAC name of (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol (CID 103395508) is (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol.
What is the SMILES notation for (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The canonical SMILES for (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol is COc1ccc(C(O)c2cc(OC)ncn2)c(F)c1.
What is the InChIKey of (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The InChIKey is TZWGEVWLHVEFRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN2O3/c1-18-8-3-4-9(10(14)5-8)13(17)11-6-12(19-2)16-7-15-11/h3-7,13,17H,1-2H3.
What are the key properties of (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol has a molecular weight of 264.26 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol is sourced from PubChem (CID 103395508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).