2-methyl-5-(trifluoromethyl)pyridine

C7H6F3N — CID 18361873

IUPAC2-methyl-5-(trifluoromethyl)pyridine
SMILESCc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C7H6F3N/c1-5-2-3-6(4-11-5)7(8,9)10/h2-4H,1H3
InChIKeyZBCOTWQYKCHKQK-UHFFFAOYSA-N
MW161.13 g/mol
LogP2.41
Rot. Bonds

About 2-methyl-5-(trifluoromethyl)pyridine

2-methyl-5-(trifluoromethyl)pyridine (PubChem CID 18361873) has the molecular formula C7H6F3N and a molecular weight of 161.13 g/mol. Its IUPAC name is 2-methyl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-methyl-5-(trifluoromethyl)pyridine
PubChem CID18361873
Molecular FormulaC7H6F3N
Molecular Weight161.13 g/mol
Exact Mass161.05
IUPAC Name2-methyl-5-(trifluoromethyl)pyridine
SMILESCc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C7H6F3N/c1-5-2-3-6(4-11-5)7(8,9)10/h2-4H,1H3
InChIKeyZBCOTWQYKCHKQK-UHFFFAOYSA-N
XLogP2.41
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.13
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-methyl-5-(trifluoromethyl)pyridine (CID 18361873) is 2-methyl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-methyl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-methyl-5-(trifluoromethyl)pyridine is Cc1ccc(C(F)(F)F)cn1.
What is the InChIKey of 2-methyl-5-(trifluoromethyl)pyridine?
The InChIKey is ZBCOTWQYKCHKQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N/c1-5-2-3-6(4-11-5)7(8,9)10/h2-4H,1H3.
What are the key properties of 2-methyl-5-(trifluoromethyl)pyridine?
2-methyl-5-(trifluoromethyl)pyridine has a molecular weight of 161.13 g/mol, XLogP of 2.41, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 18361873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).