[4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol

C15H17ClN2O3 — CID 107742985

IUPAC[4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol
SMILESCCCc1nc(Cl)cc(Oc2ccc(CO)cc2OC)n1
InChIInChI=1S/C15H17ClN2O3/c1-3-4-14-17-13(16)8-15(18-14)21-11-6-5-10(9-19)7-12(11)20-2/h5-8,19H,3-4,9H2,1-2H3
InChIKeyUOLDKPWIBBQQPH-UHFFFAOYSA-N
MW308.77 g/mol
LogP3.38
Rot. Bonds6

About [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol

[4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol (PubChem CID 107742985) has the molecular formula C15H17ClN2O3 and a molecular weight of 308.77 g/mol. Its IUPAC name is [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol.

Molecular Properties

Compound Name[4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol
PubChem CID107742985
Molecular FormulaC15H17ClN2O3
Molecular Weight308.77 g/mol
Exact Mass308.09
IUPAC Name[4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol
SMILESCCCc1nc(Cl)cc(Oc2ccc(CO)cc2OC)n1
InChIInChI=1S/C15H17ClN2O3/c1-3-4-14-17-13(16)8-15(18-14)21-11-6-5-10(9-19)7-12(11)20-2/h5-8,19H,3-4,9H2,1-2H3
InChIKeyUOLDKPWIBBQQPH-UHFFFAOYSA-N
XLogP3.38
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.77
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-6-(4-ethyl-2-methoxyphenoxy)-2-(methoxymethyl)pyrimidine
CID 107664612
4-bromo-6-(4-ethyl-2-methoxyphenoxy)-2-propylpyrimidine
CID 107664626
4-chloro-6-(2-chloro-4-fluorophenoxy)-2-propylpyrimidine
CID 80939586
4-chloro-2-[(3,4-dimethoxyphenyl)methyl]-6-ethoxypyrimidine
CID 82169576
4-chloro-6-(5-chloro-2-methylphenoxy)-2-propylpyrimidine
CID 80938340
[4-[2-amino-6-(ethylamino)pyrimidin-4-yl]oxy-3-methoxyphenyl]methanol
CID 107745130
[4-[[6-(ethylamino)-2-pyridinyl]oxy]-3-methoxyphenyl]methanol
CID 107745044
4-chloro-6-(2-fluoro-5-methylphenoxy)-2-propylpyrimidine
CID 80940227
2-[4-(hydroxymethyl)-2-methoxyphenoxy]-6-methylpyridine-4-carboxamide
CID 107743933
[4-(5,6-dimethylpyrazin-2-yl)oxy-3-methoxyphenyl]methanol
CID 107744072
[4-[6-(hydroxymethyl)pyrazin-2-yl]oxy-3-methoxyphenyl]methanol
CID 107744185
(3-methoxy-4-pyridin-2-yloxyphenyl)methanol
CID 103610323

Frequently Asked Questions

What is the IUPAC name of [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol?
The IUPAC name of [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol (CID 107742985) is [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol.
What is the SMILES notation for [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol?
The canonical SMILES for [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol is CCCc1nc(Cl)cc(Oc2ccc(CO)cc2OC)n1.
What is the InChIKey of [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol?
The InChIKey is UOLDKPWIBBQQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O3/c1-3-4-14-17-13(16)8-15(18-14)21-11-6-5-10(9-19)7-12(11)20-2/h5-8,19H,3-4,9H2,1-2H3.
What are the key properties of [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol?
[4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol has a molecular weight of 308.77 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-chloro-2-propylpyrimidin-4-yl)oxy-3-methoxyphenyl]methanol is sourced from PubChem (CID 107742985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).