2-(3-butyl-2-methylphenyl)pyridine

C16H19N — CID 161168281

IUPAC2-(3-butyl-2-methylphenyl)pyridine
SMILESCCCCc1cccc(-c2ccccn2)c1C
InChIInChI=1S/C16H19N/c1-3-4-8-14-9-7-10-15(13(14)2)16-11-5-6-12-17-16/h5-7,9-12H,3-4,8H2,1-2H3
InChIKeyAIXBQOCTVKWBPH-UHFFFAOYSA-N
MW225.34 g/mol
LogP4.40
Rot. Bonds4

About 2-(3-butyl-2-methylphenyl)pyridine

2-(3-butyl-2-methylphenyl)pyridine (PubChem CID 161168281) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is 2-(3-butyl-2-methylphenyl)pyridine.

Molecular Properties

Compound Name2-(3-butyl-2-methylphenyl)pyridine
PubChem CID161168281
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name2-(3-butyl-2-methylphenyl)pyridine
SMILESCCCCc1cccc(-c2ccccn2)c1C
InChIInChI=1S/C16H19N/c1-3-4-8-14-9-7-10-15(13(14)2)16-11-5-6-12-17-16/h5-7,9-12H,3-4,8H2,1-2H3
InChIKeyAIXBQOCTVKWBPH-UHFFFAOYSA-N
XLogP4.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-butylphenyl)pyridine
CID 11977286
2-(2-octylphenyl)pyridine
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2-(2,6-dibutyl-4-chlorophenyl)pyridine
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2-pyridin-2-yl-3-tetradecylpyridine
CID 69057571
2-(2-methylphenyl)pyridine
CID 144596153
2-methyl-3-pyridin-2-ylbenzenethiol
CID 66915624
4-butyl-3,6-dipyridin-2-ylpyridazine
CID 6418950
2-(2-fluoro-3-methylphenyl)pyridine
CID 175536337
3,4-di(nonadecyl)-2-pyridin-2-ylpyridine
CID 164513177
2-(2-pyridin-2-ylphenyl)ethanamine
CID 22356817
2-(2-ethylphenyl)-6-pyridin-2-ylpyridine
CID 163435471
2-[2,3,4-tris(2,3-dimethylphenyl)phenyl]pyridine
CID 140795086

Frequently Asked Questions

What is the IUPAC name of 2-(3-butyl-2-methylphenyl)pyridine?
The IUPAC name of 2-(3-butyl-2-methylphenyl)pyridine (CID 161168281) is 2-(3-butyl-2-methylphenyl)pyridine.
What is the SMILES notation for 2-(3-butyl-2-methylphenyl)pyridine?
The canonical SMILES for 2-(3-butyl-2-methylphenyl)pyridine is CCCCc1cccc(-c2ccccn2)c1C.
What is the InChIKey of 2-(3-butyl-2-methylphenyl)pyridine?
The InChIKey is AIXBQOCTVKWBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-3-4-8-14-9-7-10-15(13(14)2)16-11-5-6-12-17-16/h5-7,9-12H,3-4,8H2,1-2H3.
What are the key properties of 2-(3-butyl-2-methylphenyl)pyridine?
2-(3-butyl-2-methylphenyl)pyridine has a molecular weight of 225.34 g/mol, XLogP of 4.40, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-butyl-2-methylphenyl)pyridine is sourced from PubChem (CID 161168281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).