[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol

C10H12F3NO2 — CID 79158379

IUPAC[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol
SMILESCc1ccc(OCCC(F)(F)F)c(CO)n1
InChIInChI=1S/C10H12F3NO2/c1-7-2-3-9(8(6-15)14-7)16-5-4-10(11,12)13/h2-3,15H,4-6H2,1H3
InChIKeyJKGLVJLSUPOEPP-UHFFFAOYSA-N
MW235.20 g/mol
LogP2.21
Rot. Bonds4

About [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol

[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol (PubChem CID 79158379) has the molecular formula C10H12F3NO2 and a molecular weight of 235.20 g/mol. Its IUPAC name is [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol
PubChem CID79158379
Molecular FormulaC10H12F3NO2
Molecular Weight235.20 g/mol
Exact Mass235.08
IUPAC Name[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol
SMILESCc1ccc(OCCC(F)(F)F)c(CO)n1
InChIInChI=1S/C10H12F3NO2/c1-7-2-3-9(8(6-15)14-7)16-5-4-10(11,12)13/h2-3,15H,4-6H2,1H3
InChIKeyJKGLVJLSUPOEPP-UHFFFAOYSA-N
XLogP2.21
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.20
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(hydroxymethyl)-6-methyl-3-pyridinyl]oxy]-2-methylbutan-2-ol
CID 79356219
1-[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]propan-2-amine
CID 79168592
[3-[3-(dimethylamino)propoxy]-6-methyl-2-pyridinyl]methanol
CID 114525688
[3-(3-methoxypropoxy)-6-methyl-2-pyridinyl]methanol
CID 79157840
[6-methyl-3-(4,4,4-trifluorobutoxy)-2-pyridinyl]methanamine
CID 113326257
[3-(2-cyclopropylethoxy)-6-methyl-2-pyridinyl]methanol
CID 79156315
[3-[2-(2-methoxyphenoxy)ethoxy]-6-methyl-2-pyridinyl]methanol
CID 79158678
2-methyl-N-[[6-methyl-3-(4,4,4-trifluorobutoxy)-2-pyridinyl]methyl]propan-2-amine
CID 115513270
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]butan-1-ol
CID 103175334
[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 105444645
[6-methyl-3-(pyrimidin-2-ylmethoxy)-2-pyridinyl]methanol
CID 79158019
3-[(2-ethyl-6-methyl-3-pyridinyl)oxy]propanoic acid
CID 103174229

Frequently Asked Questions

What is the IUPAC name of [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol?
The IUPAC name of [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol (CID 79158379) is [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol.
What is the SMILES notation for [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol?
The canonical SMILES for [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol is Cc1ccc(OCCC(F)(F)F)c(CO)n1.
What is the InChIKey of [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol?
The InChIKey is JKGLVJLSUPOEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO2/c1-7-2-3-9(8(6-15)14-7)16-5-4-10(11,12)13/h2-3,15H,4-6H2,1H3.
What are the key properties of [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol?
[6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol has a molecular weight of 235.20 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-3-(3,3,3-trifluoropropoxy)-2-pyridinyl]methanol is sourced from PubChem (CID 79158379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).