3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine

C17H13FN2 — CID 73356735

IUPAC3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine
SMILESFc1cncc(Cc2ccc(-c3ccccc3)nc2)c1
InChIInChI=1S/C17H13FN2/c18-16-9-14(10-19-12-16)8-13-6-7-17(20-11-13)15-4-2-1-3-5-15/h1-7,9-12H,8H2
InChIKeySBONIOISLSSPAT-UHFFFAOYSA-N
MW264.30 g/mol
LogP3.87
Rot. Bonds3

About 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine

3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine (PubChem CID 73356735) has the molecular formula C17H13FN2 and a molecular weight of 264.30 g/mol. Its IUPAC name is 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine.

Molecular Properties

Compound Name3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine
PubChem CID73356735
Molecular FormulaC17H13FN2
Molecular Weight264.30 g/mol
Exact Mass264.11
IUPAC Name3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine
SMILESFc1cncc(Cc2ccc(-c3ccccc3)nc2)c1
InChIInChI=1S/C17H13FN2/c18-16-9-14(10-19-12-16)8-13-6-7-17(20-11-13)15-4-2-1-3-5-15/h1-7,9-12H,8H2
InChIKeySBONIOISLSSPAT-UHFFFAOYSA-N
XLogP3.87
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine?
The IUPAC name of 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine (CID 73356735) is 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine.
What is the SMILES notation for 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine?
The canonical SMILES for 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine is Fc1cncc(Cc2ccc(-c3ccccc3)nc2)c1.
What is the InChIKey of 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine?
The InChIKey is SBONIOISLSSPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2/c18-16-9-14(10-19-12-16)8-13-6-7-17(20-11-13)15-4-2-1-3-5-15/h1-7,9-12H,8H2.
What are the key properties of 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine?
3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine has a molecular weight of 264.30 g/mol, XLogP of 3.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-[(6-phenyl-3-pyridinyl)methyl]pyridine is sourced from PubChem (CID 73356735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).