1-methyl-2-methylidene-4-(trifluoromethyl)pyridine

C8H8F3N — CID 145172787

IUPAC1-methyl-2-methylidene-4-(trifluoromethyl)pyridine
SMILESC=C1C=C(C(F)(F)F)C=CN1C
InChIInChI=1S/C8H8F3N/c1-6-5-7(8(9,10)11)3-4-12(6)2/h3-5H,1H2,2H3
InChIKeyRYLYASVCLFEUSO-UHFFFAOYSA-N
MW175.15 g/mol
LogP2.45
Rot. Bonds

About 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine

1-methyl-2-methylidene-4-(trifluoromethyl)pyridine (PubChem CID 145172787) has the molecular formula C8H8F3N and a molecular weight of 175.15 g/mol. Its IUPAC name is 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name1-methyl-2-methylidene-4-(trifluoromethyl)pyridine
PubChem CID145172787
Molecular FormulaC8H8F3N
Molecular Weight175.15 g/mol
Exact Mass175.06
IUPAC Name1-methyl-2-methylidene-4-(trifluoromethyl)pyridine
SMILESC=C1C=C(C(F)(F)F)C=CN1C
InChIInChI=1S/C8H8F3N/c1-6-5-7(8(9,10)11)3-4-12(6)2/h3-5H,1H2,2H3
InChIKeyRYLYASVCLFEUSO-UHFFFAOYSA-N
XLogP2.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.15
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine?
The IUPAC name of 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine (CID 145172787) is 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine?
The canonical SMILES for 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine is C=C1C=C(C(F)(F)F)C=CN1C.
What is the InChIKey of 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine?
The InChIKey is RYLYASVCLFEUSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N/c1-6-5-7(8(9,10)11)3-4-12(6)2/h3-5H,1H2,2H3.
What are the key properties of 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine?
1-methyl-2-methylidene-4-(trifluoromethyl)pyridine has a molecular weight of 175.15 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-methylidene-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 145172787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).