2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine

C15H12F3N — CID 11964180

IUPAC2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine
SMILESC/C=C/c1ccc(C(F)(F)F)cc1-c1ccccn1
InChIInChI=1S/C15H12F3N/c1-2-5-11-7-8-12(15(16,17)18)10-13(11)14-6-3-4-9-19-14/h2-10H,1H3/b5-2+
InChIKeyQJRLBEYUAQSTFU-GORDUTHDSA-N
MW263.26 g/mol
LogP4.80
Rot. Bonds2

About 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine

2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine (PubChem CID 11964180) has the molecular formula C15H12F3N and a molecular weight of 263.26 g/mol. Its IUPAC name is 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine
PubChem CID11964180
Molecular FormulaC15H12F3N
Molecular Weight263.26 g/mol
Exact Mass263.09
IUPAC Name2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine
SMILESC/C=C/c1ccc(C(F)(F)F)cc1-c1ccccn1
InChIInChI=1S/C15H12F3N/c1-2-5-11-7-8-12(15(16,17)18)10-13(11)14-6-3-4-9-19-14/h2-10H,1H3/b5-2+
InChIKeyQJRLBEYUAQSTFU-GORDUTHDSA-N
XLogP4.80
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[5-methyl-2-[(Z)-prop-1-enyl]phenyl]pyridine
CID 90050951
2-[5-(4-methylphenyl)-2-[(Z)-prop-1-enyl]phenyl]pyridine
CID 118204402
2-[2-[(E)-2-(2-methylphenyl)ethenyl]-4-(trifluoromethyl)phenyl]pyridine
CID 102107805
2-[2-methyl-3,5-bis(trifluoromethyl)phenyl]pyridine
CID 144740114
2-fluoro-1-[(Z)-prop-1-enyl]-4-(trifluoromethyl)benzene
CID 156793075
2-[5-tert-butyl-2-(4-tert-butyl-2-pyridin-2-ylphenyl)phenyl]pyridine
CID 155908951
2-[2-(2-pyridin-2-ylethenyl)phenyl]-4-(trifluoromethyl)phenol
CID 175530136
2-[2-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-5-(trifluoromethyl)phenyl]pyridine
CID 102097067
2-pyrimidin-2-yl-4-(trifluoromethyl)phenolate
CID 153435357
4-methyl-5-pyridin-2-yl-2-[3-(trifluoromethyl)phenyl]pyridine
CID 168822169
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406
2-[2-[2-(2-pyridin-2-ylphenyl)ethenyl]phenyl]pyridine
CID 154584408

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine (CID 11964180) is 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine is C/C=C/c1ccc(C(F)(F)F)cc1-c1ccccn1.
What is the InChIKey of 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine?
The InChIKey is QJRLBEYUAQSTFU-GORDUTHDSA-N. The full InChI is InChI=1S/C15H12F3N/c1-2-5-11-7-8-12(15(16,17)18)10-13(11)14-6-3-4-9-19-14/h2-10H,1H3/b5-2+.
What are the key properties of 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine?
2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine has a molecular weight of 263.26 g/mol, XLogP of 4.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(E)-prop-1-enyl]-5-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 11964180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).