2-butyl-6-phenylpyridine

C15H17N — CID 4614438

IUPAC2-butyl-6-phenylpyridine
SMILESCCCCc1cccc(-c2ccccc2)n1
InChIInChI=1S/C15H17N/c1-2-3-10-14-11-7-12-15(16-14)13-8-5-4-6-9-13/h4-9,11-12H,2-3,10H2,1H3
InChIKeyDSCUZYVYDVDBTP-UHFFFAOYSA-N
MW211.31 g/mol
LogP4.09
Rot. Bonds4

About 2-butyl-6-phenylpyridine

2-butyl-6-phenylpyridine (PubChem CID 4614438) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-butyl-6-phenylpyridine.

Molecular Properties

Compound Name2-butyl-6-phenylpyridine
PubChem CID4614438
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name2-butyl-6-phenylpyridine
SMILESCCCCc1cccc(-c2ccccc2)n1
InChIInChI=1S/C15H17N/c1-2-3-10-14-11-7-12-15(16-14)13-8-5-4-6-9-13/h4-9,11-12H,2-3,10H2,1H3
InChIKeyDSCUZYVYDVDBTP-UHFFFAOYSA-N
XLogP4.09
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-butyl-6-phenylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-phenylpyridine?
The IUPAC name of 2-butyl-6-phenylpyridine (CID 4614438) is 2-butyl-6-phenylpyridine.
What is the SMILES notation for 2-butyl-6-phenylpyridine?
The canonical SMILES for 2-butyl-6-phenylpyridine is CCCCc1cccc(-c2ccccc2)n1.
What is the InChIKey of 2-butyl-6-phenylpyridine?
The InChIKey is DSCUZYVYDVDBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N/c1-2-3-10-14-11-7-12-15(16-14)13-8-5-4-6-9-13/h4-9,11-12H,2-3,10H2,1H3.
What are the key properties of 2-butyl-6-phenylpyridine?
2-butyl-6-phenylpyridine has a molecular weight of 211.31 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-phenylpyridine is sourced from PubChem (CID 4614438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).