1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine

C8H10F3N — CID 135234763

IUPAC1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine
SMILESCC1=CC=CC(C(F)(F)F)N1C
InChIInChI=1S/C8H10F3N/c1-6-4-3-5-7(12(6)2)8(9,10)11/h3-5,7H,1-2H3
InChIKeyHFMCLEWHCXKCJW-UHFFFAOYSA-N
MW177.17 g/mol
LogP2.32
Rot. Bonds

About 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine

1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine (PubChem CID 135234763) has the molecular formula C8H10F3N and a molecular weight of 177.17 g/mol. Its IUPAC name is 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine.

Molecular Properties

Compound Name1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine
PubChem CID135234763
Molecular FormulaC8H10F3N
Molecular Weight177.17 g/mol
Exact Mass177.08
IUPAC Name1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine
SMILESCC1=CC=CC(C(F)(F)F)N1C
InChIInChI=1S/C8H10F3N/c1-6-4-3-5-7(12(6)2)8(9,10)11/h3-5,7H,1-2H3
InChIKeyHFMCLEWHCXKCJW-UHFFFAOYSA-N
XLogP2.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.17
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-2,6-lutidine
CID 68311864
lithium N,N-dimethyl-4-(trifluoromethyl)benzene-5-id-1-amine
CID 57534395
magnesium;N,N-dimethyl-4-(trifluoromethyl)benzene-5-id-1-amine;bromide
CID 57534410
2-Methylidene-1-(2-methylpropyl)-5-(trifluoromethyl)pyridine
CID 67473380
6-fluoro-1,2-dimethyl-2H-pyridine
CID 68233586
6-but-1-ynyl-2-(fluoromethyl)-1-methyl-2H-pyridine
CID 69376464
2-Methyl-6-(trifluoromethyl)-1,2-dihydropyridine
CID 118214483
2-ethyl-1,6-dimethyl-4-(trifluoromethyl)-2H-pyridine
CID 123161901
N-ethenyl-7-methyl-N-(2,2,2-trifluoroethyl)cyclohepta-1,3,6-trien-1-amine
CID 123191642
1-Ethyl-2-methylidene-5-(trifluoromethyl)pyridine
CID 123548735
1,6-dimethyl-4-(trifluoromethyl)-2H-pyridine
CID 123633847
N,N-diethyl-4-fluorocyclohexa-1,5-dien-1-amine
CID 126629579

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine?
The IUPAC name of 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine (CID 135234763) is 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine.
What is the SMILES notation for 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine?
The canonical SMILES for 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine is CC1=CC=CC(C(F)(F)F)N1C.
What is the InChIKey of 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine?
The InChIKey is HFMCLEWHCXKCJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N/c1-6-4-3-5-7(12(6)2)8(9,10)11/h3-5,7H,1-2H3.
What are the key properties of 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine?
1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine has a molecular weight of 177.17 g/mol, XLogP of 2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-2-(trifluoromethyl)-2H-pyridine is sourced from PubChem (CID 135234763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).