(2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol

C15H18N2O2 — CID 115527943

IUPAC(2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol
SMILESCc1nccc(C(O)c2ccccc2OC(C)C)n1
InChIInChI=1S/C15H18N2O2/c1-10(2)19-14-7-5-4-6-12(14)15(18)13-8-9-16-11(3)17-13/h4-10,15,18H,1-3H3
InChIKeyLMPGCSDNYJZWFG-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.65
Rot. Bonds4

About (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol

(2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol (PubChem CID 115527943) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol.

Molecular Properties

Compound Name(2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol
PubChem CID115527943
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name(2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol
SMILESCc1nccc(C(O)c2ccccc2OC(C)C)n1
InChIInChI=1S/C15H18N2O2/c1-10(2)19-14-7-5-4-6-12(14)15(18)13-8-9-16-11(3)17-13/h4-10,15,18H,1-3H3
InChIKeyLMPGCSDNYJZWFG-UHFFFAOYSA-N
XLogP2.65
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 ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-chlorophenyl)-(2-methylpyrimidin-4-yl)methanol
CID 115527894
(2-methylpyrimidin-4-yl)-[2-(trifluoromethyl)phenyl]methanol
CID 115527988
(2-methylpyrimidin-4-yl)-quinolin-8-ylmethanol
CID 115527954
isoquinolin-5-yl-(2-methylpyrimidin-4-yl)methanol
CID 115527932
isoquinolin-8-yl-(2-methylpyrimidin-4-yl)methanol
CID 103143046
4-[hydroxy-(2-propan-2-yloxyphenyl)methyl]benzonitrile
CID 115480983
1-(2-propan-2-yloxyphenyl)propane-1,2-diol
CID 103452569
(2-methylpyrimidin-4-yl)-[2-(trifluoromethoxy)phenyl]methanamine
CID 115530155
(3,5-dibromophenyl)-(2-propan-2-yloxyphenyl)methanol
CID 107978570
(3,4-dimethoxyphenyl)-(2-methylpyrimidin-4-yl)methanol
CID 115527861
4-methyl-3-(2-methylpyrimidin-4-yl)pentan-2-ol
CID 63200606
(2-propan-2-yloxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 105117017

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol?
The IUPAC name of (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol (CID 115527943) is (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol is Cc1nccc(C(O)c2ccccc2OC(C)C)n1.
What is the InChIKey of (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol?
The InChIKey is LMPGCSDNYJZWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(2)19-14-7-5-4-6-12(14)15(18)13-8-9-16-11(3)17-13/h4-10,15,18H,1-3H3.
What are the key properties of (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol?
(2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol has a molecular weight of 258.32 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrimidin-4-yl)-(2-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 115527943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).