2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine

C13H10F3NO — CID 15901290

IUPAC2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine
SMILESCOc1cccc(-c2ccc(C(F)(F)F)cn2)c1
InChIInChI=1S/C13H10F3NO/c1-18-11-4-2-3-9(7-11)12-6-5-10(8-17-12)13(14,15)16/h2-8H,1H3
InChIKeyWNCPHYQOEBGTSR-UHFFFAOYSA-N
MW253.22 g/mol
LogP3.78
Rot. Bonds2

About 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine

2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine (PubChem CID 15901290) has the molecular formula C13H10F3NO and a molecular weight of 253.22 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine
PubChem CID15901290
Molecular FormulaC13H10F3NO
Molecular Weight253.22 g/mol
Exact Mass253.07
IUPAC Name2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine
SMILESCOc1cccc(-c2ccc(C(F)(F)F)cn2)c1
InChIInChI=1S/C13H10F3NO/c1-18-11-4-2-3-9(7-11)12-6-5-10(8-17-12)13(14,15)16/h2-8H,1H3
InChIKeyWNCPHYQOEBGTSR-UHFFFAOYSA-N
XLogP3.78
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.22
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Pilavapadin
CID 118419773
4-[2-(3,5-Dimethoxy-phenyl)-vinyl]-pyridine
CID 11957947
6-Methoxyquinoline
CID 14860
4-[2-(4-Methoxy-phenyl)-vinyl]-pyridine
CID 735606
8-Methoxyquinoline
CID 70310
6-Methoxy-4-methylquinoline
CID 258761
4-Methoxyquinoline
CID 521938
1-Benzyl-6-methoxy-4-methylquinolinium chloride
CID 2834440
2-[2-(3-Methoxyphenyl)ethynyl]-6-methylpyridine
CID 5311462
3-{[(1E)-5-methoxy-2,3-dihydro-1H-inden-1-ylidene]methyl}pyridine
CID 6539769
(3-Pyridylmethylene)indane 11b
CID 6539770
3-{[(1E)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-ylidene]methyl}pyridine
CID 6539771

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine (CID 15901290) is 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine is COc1cccc(-c2ccc(C(F)(F)F)cn2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine?
The InChIKey is WNCPHYQOEBGTSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3NO/c1-18-11-4-2-3-9(7-11)12-6-5-10(8-17-12)13(14,15)16/h2-8H,1H3.
What are the key properties of 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine?
2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine has a molecular weight of 253.22 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 15901290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).