3-phenylpyridine

C11H9N — CID 13886

IUPAC3-phenylpyridine
SMILESc1ccc(-c2cccnc2)cc1
InChIInChI=1S/C11H9N/c1-2-5-10(6-3-1)11-7-4-8-12-9-11/h1-9H
InChIKeyHJKGBRPNSJADMB-UHFFFAOYSA-N
MW155.20 g/mol
LogP2.75
Rot. Bonds1

About 3-phenylpyridine

3-phenylpyridine (PubChem CID 13886) has the molecular formula C11H9N and a molecular weight of 155.20 g/mol. Its IUPAC name is 3-phenylpyridine.

Molecular Properties

Compound Name3-phenylpyridine
PubChem CID13886
Molecular FormulaC11H9N
Molecular Weight155.20 g/mol
Exact Mass155.07
IUPAC Name3-phenylpyridine
SMILESc1ccc(-c2cccnc2)cc1
InChIInChI=1S/C11H9N/c1-2-5-10(6-3-1)11-7-4-8-12-9-11/h1-9H
InChIKeyHJKGBRPNSJADMB-UHFFFAOYSA-N
XLogP2.75
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-phenylpyridine?
The IUPAC name of 3-phenylpyridine (CID 13886) is 3-phenylpyridine.
What is the SMILES notation for 3-phenylpyridine?
The canonical SMILES for 3-phenylpyridine is c1ccc(-c2cccnc2)cc1.
What is the InChIKey of 3-phenylpyridine?
The InChIKey is HJKGBRPNSJADMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N/c1-2-5-10(6-3-1)11-7-4-8-12-9-11/h1-9H.
What are the key properties of 3-phenylpyridine?
3-phenylpyridine has a molecular weight of 155.20 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylpyridine is sourced from PubChem (CID 13886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).