2,5-dimethyl-4-phenylpyridine

C13H13N — CID 603086

IUPAC2,5-dimethyl-4-phenylpyridine
SMILESCc1cc(-c2ccccc2)c(C)cn1
InChIInChI=1S/C13H13N/c1-10-9-14-11(2)8-13(10)12-6-4-3-5-7-12/h3-9H,1-2H3
InChIKeyFLUUXYWRWDICST-UHFFFAOYSA-N
MW183.25 g/mol
LogP3.37
Rot. Bonds1

About 2,5-dimethyl-4-phenylpyridine

2,5-dimethyl-4-phenylpyridine (PubChem CID 603086) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is 2,5-dimethyl-4-phenylpyridine.

Molecular Properties

Compound Name2,5-dimethyl-4-phenylpyridine
PubChem CID603086
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name2,5-dimethyl-4-phenylpyridine
SMILESCc1cc(-c2ccccc2)c(C)cn1
InChIInChI=1S/C13H13N/c1-10-9-14-11(2)8-13(10)12-6-4-3-5-7-12/h3-9H,1-2H3
InChIKeyFLUUXYWRWDICST-UHFFFAOYSA-N
XLogP3.37
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-phenylpyridine?
The IUPAC name of 2,5-dimethyl-4-phenylpyridine (CID 603086) is 2,5-dimethyl-4-phenylpyridine.
What is the SMILES notation for 2,5-dimethyl-4-phenylpyridine?
The canonical SMILES for 2,5-dimethyl-4-phenylpyridine is Cc1cc(-c2ccccc2)c(C)cn1.
What is the InChIKey of 2,5-dimethyl-4-phenylpyridine?
The InChIKey is FLUUXYWRWDICST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c1-10-9-14-11(2)8-13(10)12-6-4-3-5-7-12/h3-9H,1-2H3.
What are the key properties of 2,5-dimethyl-4-phenylpyridine?
2,5-dimethyl-4-phenylpyridine has a molecular weight of 183.25 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-phenylpyridine is sourced from PubChem (CID 603086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).