4-methoxy-5-propyl-2-(trifluoromethyl)pyridine

C10H12F3NO — CID 146203675

IUPAC4-methoxy-5-propyl-2-(trifluoromethyl)pyridine
SMILESCCCc1cnc(C(F)(F)F)cc1OC
InChIInChI=1S/C10H12F3NO/c1-3-4-7-6-14-9(10(11,12)13)5-8(7)15-2/h5-6H,3-4H2,1-2H3
InChIKeyYCDCMFCBKGOZLS-UHFFFAOYSA-N
MW219.21 g/mol
LogP3.06
Rot. Bonds3

About 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine

4-methoxy-5-propyl-2-(trifluoromethyl)pyridine (PubChem CID 146203675) has the molecular formula C10H12F3NO and a molecular weight of 219.21 g/mol. Its IUPAC name is 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name4-methoxy-5-propyl-2-(trifluoromethyl)pyridine
PubChem CID146203675
Molecular FormulaC10H12F3NO
Molecular Weight219.21 g/mol
Exact Mass219.09
IUPAC Name4-methoxy-5-propyl-2-(trifluoromethyl)pyridine
SMILESCCCc1cnc(C(F)(F)F)cc1OC
InChIInChI=1S/C10H12F3NO/c1-3-4-7-6-14-9(10(11,12)13)5-8(7)15-2/h5-6H,3-4H2,1-2H3
InChIKeyYCDCMFCBKGOZLS-UHFFFAOYSA-N
XLogP3.06
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.21
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine?
The IUPAC name of 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine (CID 146203675) is 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine?
The canonical SMILES for 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine is CCCc1cnc(C(F)(F)F)cc1OC.
What is the InChIKey of 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine?
The InChIKey is YCDCMFCBKGOZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO/c1-3-4-7-6-14-9(10(11,12)13)5-8(7)15-2/h5-6H,3-4H2,1-2H3.
What are the key properties of 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine?
4-methoxy-5-propyl-2-(trifluoromethyl)pyridine has a molecular weight of 219.21 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-5-propyl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 146203675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).