(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol

C12H13N3O3 — CID 102950306

IUPAC(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCOc1cncc(C(O)c2cc(OC)ncn2)c1
InChIInChI=1S/C12H13N3O3/c1-17-9-3-8(5-13-6-9)12(16)10-4-11(18-2)15-7-14-10/h3-7,12,16H,1-2H3
InChIKeyRIRWORLJXUCAEB-UHFFFAOYSA-N
MW247.25 g/mol
LogP0.97
Rot. Bonds4

About (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol

(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol (PubChem CID 102950306) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol.

Molecular Properties

Compound Name(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
PubChem CID102950306
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC Name(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCOc1cncc(C(O)c2cc(OC)ncn2)c1
InChIInChI=1S/C12H13N3O3/c1-17-9-3-8(5-13-6-9)12(16)10-4-11(18-2)15-7-14-10/h3-7,12,16H,1-2H3
InChIKeyRIRWORLJXUCAEB-UHFFFAOYSA-N
XLogP0.97
TPSA77.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5-methoxy-3-pyridinyl)-(1-methylimidazol-4-yl)methanol
CID 107978609
(5-methoxy-3-pyridinyl)-(thiadiazol-4-yl)methanol
CID 105121227
(5-fluoro-3-pyridinyl)-(5-methoxy-3-pyridinyl)methanol
CID 105121302
(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950531
(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 103395508
(5-chlorofuran-2-yl)-(5-methoxy-3-pyridinyl)methanol
CID 106693953
(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950429
(2-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950226
2,2-difluoro-1-(5-methoxy-3-pyridinyl)ethanol
CID 112575542
(3-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanamine
CID 102950866
1-(5-methoxy-3-pyridinyl)-2,2-dimethylbutan-1-amine
CID 105026104
(2-fluorophenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950386

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol?
The IUPAC name of (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol (CID 102950306) is (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol.
What is the SMILES notation for (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol?
The canonical SMILES for (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol is COc1cncc(C(O)c2cc(OC)ncn2)c1.
What is the InChIKey of (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol?
The InChIKey is RIRWORLJXUCAEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3/c1-17-9-3-8(5-13-6-9)12(16)10-4-11(18-2)15-7-14-10/h3-7,12,16H,1-2H3.
What are the key properties of (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol?
(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol has a molecular weight of 247.25 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol is sourced from PubChem (CID 102950306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).