2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine

C11H12F3N — CID 146866757

IUPAC2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine
SMILESC=C(C)c1nc(C)c(C)cc1C(F)(F)F
InChIInChI=1S/C11H12F3N/c1-6(2)10-9(11(12,13)14)5-7(3)8(4)15-10/h5H,1H2,2-4H3
InChIKeySMHKBZDBPWNYGF-UHFFFAOYSA-N
MW215.22 g/mol
LogP3.75
Rot. Bonds1

About 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine

2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine (PubChem CID 146866757) has the molecular formula C11H12F3N and a molecular weight of 215.22 g/mol. Its IUPAC name is 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine
PubChem CID146866757
Molecular FormulaC11H12F3N
Molecular Weight215.22 g/mol
Exact Mass215.09
IUPAC Name2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine
SMILESC=C(C)c1nc(C)c(C)cc1C(F)(F)F
InChIInChI=1S/C11H12F3N/c1-6(2)10-9(11(12,13)14)5-7(3)8(4)15-10/h5H,1H2,2-4H3
InChIKeySMHKBZDBPWNYGF-UHFFFAOYSA-N
XLogP3.75
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.22
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dimethyl-6-propan-2-yl-5-(trifluoromethyl)pyridine
CID 146614926
5-methyl-6-(trifluoromethoxy)-3-(trifluoromethyl)pyridine-2-carboxylic acid
CID 133087619
5-fluoro-2,3-dimethyl-6-(trifluoromethyl)pyridine
CID 166140585
2-[1-(2,2-dimethylpropylamino)ethenyl]-6-methyl-5-(trifluoromethyl)pyridin-3-amine
CID 156569364
1-[4,5-dimethyl-2-(trifluoromethyl)phenyl]ethanone
CID 131384993
2,5-dimethyl-4-(trifluoromethyl)phenol
CID 121432589
2-[[3,6-dimethyl-5-(trifluoromethyl)-2-pyridinyl]oxy]ethanol
CID 129306783
2,3-dimethyl-6-(trifluoromethyl)pyridine;propan-2-one
CID 143235788
1-[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]ethanone
CID 170996803
1-hydroxy-2,5-dimethyl-4-(trifluoromethyl)pyridin-1-ium
CID 143399375
[2-[difluoro(hydroxy)methyl]-4,5-dimethylphenyl]-difluoromethanol
CID 58543652
methane;4-prop-1-en-2-yl-3-(trifluoromethyl)aniline
CID 153395488

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine (CID 146866757) is 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine is C=C(C)c1nc(C)c(C)cc1C(F)(F)F.
What is the InChIKey of 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine?
The InChIKey is SMHKBZDBPWNYGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N/c1-6(2)10-9(11(12,13)14)5-7(3)8(4)15-10/h5H,1H2,2-4H3.
What are the key properties of 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine?
2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine has a molecular weight of 215.22 g/mol, XLogP of 3.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-prop-1-en-2-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 146866757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).