2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine

C19H14F3NO — CID 58901931

IUPAC2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccnc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C19H14F3NO/c20-19(21,22)17-8-6-15(7-9-17)16-10-11-23-18(12-16)24-13-14-4-2-1-3-5-14/h1-12H,13H2
InChIKeyVMOQCMHDBYOFEH-UHFFFAOYSA-N
MW329.32 g/mol
LogP5.35
Rot. Bonds4

About 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine

2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine (PubChem CID 58901931) has the molecular formula C19H14F3NO and a molecular weight of 329.32 g/mol. Its IUPAC name is 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine
PubChem CID58901931
Molecular FormulaC19H14F3NO
Molecular Weight329.32 g/mol
Exact Mass329.10
IUPAC Name2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine
SMILESFC(F)(F)c1ccc(-c2ccnc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C19H14F3NO/c20-19(21,22)17-8-6-15(7-9-17)16-10-11-23-18(12-16)24-13-14-4-2-1-3-5-14/h1-12H,13H2
InChIKeyVMOQCMHDBYOFEH-UHFFFAOYSA-N
XLogP5.35
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.32
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-phenylmethoxy-4-pyridinyl)methyl]-4-(trifluoromethyl)benzamide
CID 46469686
[2-phenylmethoxy-5-[4-(trifluoromethyl)phenyl]phenyl]methanamine
CID 172650045
[2-phenylmethoxy-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]methanol
CID 165437540
2-phenylmethoxy-5-[4-(trifluoromethyl)phenyl]benzoic acid
CID 68869462
2,4-bis[4-(trifluoromethyl)phenyl]pyridine
CID 134617794
3-[[4-(trifluoromethyl)phenyl]methoxy]pyridazine
CID 134106459
1-phenylmethoxy-4-(trifluoromethyl)benzene;4-(trifluoromethyl)phenol
CID 159669707
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
CID 71302196
3-methyl-6-phenyl-2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine
CID 162617775
2-[(4-methylphenyl)methoxy]-4-phenylmethoxypyridine
CID 67304946
N-[(2-phenylmethoxy-4-pyridinyl)methyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]sulfanyl]acetamide
CID 55715793
[3-(4-phenylmethoxyphenyl)-5-(trifluoromethyl)phenyl]methanamine
CID 156612416

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine (CID 58901931) is 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine is FC(F)(F)c1ccc(-c2ccnc(OCc3ccccc3)c2)cc1.
What is the InChIKey of 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine?
The InChIKey is VMOQCMHDBYOFEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3NO/c20-19(21,22)17-8-6-15(7-9-17)16-10-11-23-18(12-16)24-13-14-4-2-1-3-5-14/h1-12H,13H2.
What are the key properties of 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine?
2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine has a molecular weight of 329.32 g/mol, XLogP of 5.35, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-4-[4-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 58901931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).