2,5-dimethylpyridine

C7H9N — CID 11526

IUPAC2,5-dimethylpyridine
SMILESCc1ccc(C)nc1
InChIInChI=1S/C7H9N/c1-6-3-4-7(2)8-5-6/h3-5H,1-2H3
InChIKeyXWKFPIODWVPXLX-UHFFFAOYSA-N
MW107.16 g/mol
LogP1.70
Rot. Bonds

About 2,5-dimethylpyridine

2,5-dimethylpyridine (PubChem CID 11526) has the molecular formula C7H9N and a molecular weight of 107.16 g/mol. Its IUPAC name is 2,5-dimethylpyridine.

Molecular Properties

Compound Name2,5-dimethylpyridine
PubChem CID11526
Molecular FormulaC7H9N
Molecular Weight107.16 g/mol
Exact Mass107.07
IUPAC Name2,5-dimethylpyridine
SMILESCc1ccc(C)nc1
InChIInChI=1S/C7H9N/c1-6-3-4-7(2)8-5-6/h3-5H,1-2H3
InChIKeyXWKFPIODWVPXLX-UHFFFAOYSA-N
XLogP1.70
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.16
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 89594
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3-Methylpyridine
CID 7970
(+-)-Dimethindene
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3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
4-Methylpyridine
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2,2'-Bipyridine
CID 1474
Pheniramine
CID 4761
Prothionamide
CID 666418
Pralidoxime Chloride
CID 135445761

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyridine?
The IUPAC name of 2,5-dimethylpyridine (CID 11526) is 2,5-dimethylpyridine.
What is the SMILES notation for 2,5-dimethylpyridine?
The canonical SMILES for 2,5-dimethylpyridine is Cc1ccc(C)nc1.
What is the InChIKey of 2,5-dimethylpyridine?
The InChIKey is XWKFPIODWVPXLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N/c1-6-3-4-7(2)8-5-6/h3-5H,1-2H3.
What are the key properties of 2,5-dimethylpyridine?
2,5-dimethylpyridine has a molecular weight of 107.16 g/mol, XLogP of 1.70, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyridine is sourced from PubChem (CID 11526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).