(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol

C15H16N2O3 — CID 102950531

IUPAC(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCOc1cc(C(O)c2ccc(OC3CC3)cc2)ncn1
InChIInChI=1S/C15H16N2O3/c1-19-14-8-13(16-9-17-14)15(18)10-2-4-11(5-3-10)20-12-6-7-12/h2-5,8-9,12,15,18H,6-7H2,1H3
InChIKeyVIIYLYGGSSAIRO-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.11
Rot. Bonds5

About (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol

(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol (PubChem CID 102950531) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol.

Molecular Properties

Compound Name(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
PubChem CID102950531
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
SMILESCOc1cc(C(O)c2ccc(OC3CC3)cc2)ncn1
InChIInChI=1S/C15H16N2O3/c1-19-14-8-13(16-9-17-14)15(18)10-2-4-11(5-3-10)20-12-6-7-12/h2-5,8-9,12,15,18H,6-7H2,1H3
InChIKeyVIIYLYGGSSAIRO-UHFFFAOYSA-N
XLogP2.11
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-cyclopropyloxyphenyl)-(5-methyl-2-pyridinyl)methanol
CID 114518682
(4-cyclopropyloxyphenyl)-(2-methoxy-4-methylphenyl)methanol
CID 106791062
cyclobutyl-(6-methoxypyrimidin-4-yl)methanol
CID 102950436
(5-methoxy-3-pyridinyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950306
(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502
(2-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950226
(4-cyclopropyloxyphenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 115838349
(2-fluoro-4-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 103395508
(3-ethylphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950429
(3-chloro-5-methylphenyl)-(4-cyclopropyloxyphenyl)methanol
CID 115838406
(2-tert-butyl-1,3-thiazol-4-yl)-(4-cyclopropyloxyphenyl)methanol
CID 114518744
(4-cyclopropyloxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115838353

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The IUPAC name of (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol (CID 102950531) is (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol.
What is the SMILES notation for (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The canonical SMILES for (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol is COc1cc(C(O)c2ccc(OC3CC3)cc2)ncn1.
What is the InChIKey of (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
The InChIKey is VIIYLYGGSSAIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-19-14-8-13(16-9-17-14)15(18)10-2-4-11(5-3-10)20-12-6-7-12/h2-5,8-9,12,15,18H,6-7H2,1H3.
What are the key properties of (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol?
(4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol has a molecular weight of 272.30 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyloxyphenyl)-(6-methoxypyrimidin-4-yl)methanol is sourced from PubChem (CID 102950531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).