[3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol

C15H18N2O2 — CID 79868756

IUPAC[3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol
SMILESCc1cc(Oc2cccc(CO)c2)nc(C(C)C)n1
InChIInChI=1S/C15H18N2O2/c1-10(2)15-16-11(3)7-14(17-15)19-13-6-4-5-12(8-13)9-18/h4-8,10,18H,9H2,1-3H3
InChIKeyWOYCEGXUWMOMSG-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.19
Rot. Bonds4

About [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol

[3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol (PubChem CID 79868756) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol.

Molecular Properties

Compound Name[3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol
PubChem CID79868756
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name[3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol
SMILESCc1cc(Oc2cccc(CO)c2)nc(C(C)C)n1
InChIInChI=1S/C15H18N2O2/c1-10(2)15-16-11(3)7-14(17-15)19-13-6-4-5-12(8-13)9-18/h4-8,10,18H,9H2,1-3H3
InChIKeyWOYCEGXUWMOMSG-UHFFFAOYSA-N
XLogP3.19
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(Propan-2-yloxy)quinazolin-2-yl]phenol
CID 659553
2-(4-Methyl-6-phenoxypyrimidin-2-yl)phenol
CID 659561
6-(4-ethoxy-1H-quinazolin-2-ylidene)-1-cyclohexa-2,4-dienone
CID 3244112
2-(4-((2-(3-Chlorophenyl)-6-ethylpyrimidin-4-yl)oxy)phenyl)ethanol
CID 90112840
1-[3-(6-Methyl-2-phenylpyrimidin-4-yl)oxypropyl]piperidin-4-ol
CID 118722993
N,N-dimethyl-3-(6-methyl-2-phenylpyrimidin-4-yl)oxypropan-1-amine
CID 118723002
N,N-diethyl-3-(6-methyl-2-phenylpyrimidin-4-yl)oxypropan-1-amine
CID 118723003
3-(6-methyl-2-phenylpyrimidin-4-yl)oxy-N,N-dipropylpropan-1-amine
CID 118723335
2-[4-Methyl-6-(4-methylphenoxy)pyrimidin-2-yl]phenol
CID 747888
4-Methyl-6-phenoxy-2-phenylpyrimidine
CID 796212
4-(4-Ethylphenoxy)-6-methylpyrimidin-2-amine
CID 830665
4-[4-Methyl-6-(4-propyl-phenoxy)-pyrimidin-2-yl]-morpholine
CID 929670

Frequently Asked Questions

What is the IUPAC name of [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol?
The IUPAC name of [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol (CID 79868756) is [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol.
What is the SMILES notation for [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol?
The canonical SMILES for [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol is Cc1cc(Oc2cccc(CO)c2)nc(C(C)C)n1.
What is the InChIKey of [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol?
The InChIKey is WOYCEGXUWMOMSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(2)15-16-11(3)7-14(17-15)19-13-6-4-5-12(8-13)9-18/h4-8,10,18H,9H2,1-3H3.
What are the key properties of [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol?
[3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol has a molecular weight of 258.32 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol is sourced from PubChem (CID 79868756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).