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

C15H19N3O2 — CID 80962451

IUPAC[2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol
SMILESCNc1cc(Oc2ccccc2CO)nc(C(C)C)n1
InChIInChI=1S/C15H19N3O2/c1-10(2)15-17-13(16-3)8-14(18-15)20-12-7-5-4-6-11(12)9-19/h4-8,10,19H,9H2,1-3H3,(H,16,17,18)
InChIKeyMAXGQEYHKUBMBP-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.93
Rot. Bonds5

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

[2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol (PubChem CID 80962451) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol.

Molecular Properties

Compound Name[2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol
PubChem CID80962451
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name[2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol
SMILESCNc1cc(Oc2ccccc2CO)nc(C(C)C)n1
InChIInChI=1S/C15H19N3O2/c1-10(2)15-17-13(16-3)8-14(18-15)20-12-7-5-4-6-11(12)9-19/h4-8,10,19H,9H2,1-3H3,(H,16,17,18)
InChIKeyMAXGQEYHKUBMBP-UHFFFAOYSA-N
XLogP2.93
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol
CID 80966539
[2-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxyphenyl]methanol
CID 107713532
6-(2-methoxyphenoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80966343
6-(2-ethylphenoxy)-N,2-dimethylpyrimidin-4-amine
CID 80874565
[6-(2-iodophenoxy)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80980270
[2-(4-methyl-6-propan-2-ylpyrimidin-2-yl)oxyphenyl]methanol
CID 107713463
6-(furan-2-ylmethoxy)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80966171
[6-(2,3-dimethylphenoxy)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80968329
6-(2-butan-2-ylphenoxy)-N,2-dimethylpyrimidin-4-amine
CID 80881121
[2-(6-amino-2-methylsulfanylpyrimidin-4-yl)oxyphenyl]methanol
CID 80879243
2-ethyl-N-methyl-6-naphthalen-1-yloxypyrimidin-4-amine
CID 80938850
6-[(5-bromo-3-pyridinyl)oxy]-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80963572

Frequently Asked Questions

What is the IUPAC name of [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol?
The IUPAC name of [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol (CID 80962451) is [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol.
What is the SMILES notation for [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol?
The canonical SMILES for [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol is CNc1cc(Oc2ccccc2CO)nc(C(C)C)n1.
What is the InChIKey of [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol?
The InChIKey is MAXGQEYHKUBMBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10(2)15-17-13(16-3)8-14(18-15)20-12-7-5-4-6-11(12)9-19/h4-8,10,19H,9H2,1-3H3,(H,16,17,18).
What are the key properties of [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol?
[2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol has a molecular weight of 273.34 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]oxyphenyl]methanol is sourced from PubChem (CID 80962451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).