2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine

C8H10F3N — CID 135212646

IUPAC2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine
SMILESCC1C=C=C(C(F)(F)F)NC1C
InChIInChI=1S/C8H10F3N/c1-5-3-4-7(8(9,10)11)12-6(5)2/h3,5-6,12H,1-2H3
InChIKeyARMALTMPKCHJGA-UHFFFAOYSA-N
MW177.17 g/mol
LogP2.22
Rot. Bonds

About 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine

2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine (PubChem CID 135212646) has the molecular formula C8H10F3N and a molecular weight of 177.17 g/mol. Its IUPAC name is 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine.

Molecular Properties

Compound Name2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine
PubChem CID135212646
Molecular FormulaC8H10F3N
Molecular Weight177.17 g/mol
Exact Mass177.08
IUPAC Name2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine
SMILESCC1C=C=C(C(F)(F)F)NC1C
InChIInChI=1S/C8H10F3N/c1-5-3-4-7(8(9,10)11)12-6(5)2/h3,5-6,12H,1-2H3
InChIKeyARMALTMPKCHJGA-UHFFFAOYSA-N
XLogP2.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.17
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine?
The IUPAC name of 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine (CID 135212646) is 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine.
What is the SMILES notation for 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine?
The canonical SMILES for 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine is CC1C=C=C(C(F)(F)F)NC1C.
What is the InChIKey of 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine?
The InChIKey is ARMALTMPKCHJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N/c1-5-3-4-7(8(9,10)11)12-6(5)2/h3,5-6,12H,1-2H3.
What are the key properties of 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine?
2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine has a molecular weight of 177.17 g/mol, XLogP of 2.22, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-(trifluoromethyl)-2,3-dihydro-1H-pyridine is sourced from PubChem (CID 135212646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).