[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol

C7H7F3N2O — CID 71748509

IUPAC[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol
SMILESCc1ncc(CO)c(C(F)(F)F)n1
InChIInChI=1S/C7H7F3N2O/c1-4-11-2-5(3-13)6(12-4)7(8,9)10/h2,13H,3H2,1H3
InChIKeyOCPUIAMWQGFOEF-UHFFFAOYSA-N
MW192.14 g/mol
LogP1.30
Rot. Bonds1

About [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol

[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol (PubChem CID 71748509) has the molecular formula C7H7F3N2O and a molecular weight of 192.14 g/mol. Its IUPAC name is [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol
PubChem CID71748509
Molecular FormulaC7H7F3N2O
Molecular Weight192.14 g/mol
Exact Mass192.05
IUPAC Name[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol
SMILESCc1ncc(CO)c(C(F)(F)F)n1
InChIInChI=1S/C7H7F3N2O/c1-4-11-2-5(3-13)6(12-4)7(8,9)10/h2,13H,3H2,1H3
InChIKeyOCPUIAMWQGFOEF-UHFFFAOYSA-N
XLogP1.30
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.14
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-Dimethyl-5-pyrimidinemethanol
CID 98784
(4-Methylpyrimidin-5-yl)methanol
CID 24903630
1-(2,4-Dimethylpyrimidin-5-yl)ethan-1-ol
CID 54772446
(2-Methoxy-4-methylpyrimidin-5-yl)methanol
CID 83184643
(1S)-1-(4-methylpyrimidin-5-yl)ethan-1-ol
CID 91647671
(4-Methyl-2-(methylthio)pyrimidin-5-yl)methanol
CID 15063003
1-(2-Methylpyrimidin-5-yl)ethanol
CID 54772447
5-Pyrimidinemethanol, alpha-methyl-4-(trifluoromethyl)-
CID 19074096
1-[4-[Chloro(difluoro)methyl]pyrimidin-5-yl]ethanol
CID 19074105
[2-Methylsulfanyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol
CID 21220617
(2-(Trifluoromethyl)pyrimidin-4-yl)methanol
CID 55295897
(2-Amino-4-(trifluoromethyl)pyrimidin-5-yl)methanol
CID 55295966

Frequently Asked Questions

What is the IUPAC name of [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol?
The IUPAC name of [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol (CID 71748509) is [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol.
What is the SMILES notation for [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol?
The canonical SMILES for [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol is Cc1ncc(CO)c(C(F)(F)F)n1.
What is the InChIKey of [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol?
The InChIKey is OCPUIAMWQGFOEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O/c1-4-11-2-5(3-13)6(12-4)7(8,9)10/h2,13H,3H2,1H3.
What are the key properties of [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol?
[2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol has a molecular weight of 192.14 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-4-(trifluoromethyl)pyrimidin-5-yl]methanol is sourced from PubChem (CID 71748509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).