4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine

C19H16FNO — CID 46901617

IUPAC4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine
SMILESCOc1ccc(-c2ccc(Cc3ccncc3)cc2)cc1F
InChIInChI=1S/C19H16FNO/c1-22-19-7-6-17(13-18(19)20)16-4-2-14(3-5-16)12-15-8-10-21-11-9-15/h2-11,13H,12H2,1H3
InChIKeyHLHANIQYBLFGAN-UHFFFAOYSA-N
MW293.34 g/mol
LogP4.49
Rot. Bonds4

About 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine

4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine (PubChem CID 46901617) has the molecular formula C19H16FNO and a molecular weight of 293.34 g/mol. Its IUPAC name is 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine.

Molecular Properties

Compound Name4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine
PubChem CID46901617
Molecular FormulaC19H16FNO
Molecular Weight293.34 g/mol
Exact Mass293.12
IUPAC Name4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine
SMILESCOc1ccc(-c2ccc(Cc3ccncc3)cc2)cc1F
InChIInChI=1S/C19H16FNO/c1-22-19-7-6-17(13-18(19)20)16-4-2-14(3-5-16)12-15-8-10-21-11-9-15/h2-11,13H,12H2,1H3
InChIKeyHLHANIQYBLFGAN-UHFFFAOYSA-N
XLogP4.49
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine?
The IUPAC name of 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine (CID 46901617) is 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine.
What is the SMILES notation for 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine?
The canonical SMILES for 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine is COc1ccc(-c2ccc(Cc3ccncc3)cc2)cc1F.
What is the InChIKey of 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine?
The InChIKey is HLHANIQYBLFGAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO/c1-22-19-7-6-17(13-18(19)20)16-4-2-14(3-5-16)12-15-8-10-21-11-9-15/h2-11,13H,12H2,1H3.
What are the key properties of 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine?
4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine has a molecular weight of 293.34 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(3-fluoro-4-methoxyphenyl)phenyl]methyl]pyridine is sourced from PubChem (CID 46901617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).