4-(4-butylphenyl)-2-methylpyridine

C16H19N — CID 154955904

IUPAC4-(4-butylphenyl)-2-methylpyridine
SMILESCCCCc1ccc(-c2ccnc(C)c2)cc1
InChIInChI=1S/C16H19N/c1-3-4-5-14-6-8-15(9-7-14)16-10-11-17-13(2)12-16/h6-12H,3-5H2,1-2H3
InChIKeyJUXQTEGEOLTMIC-UHFFFAOYSA-N
MW225.33 g/mol
LogP4.40
Rot. Bonds4

About 4-(4-butylphenyl)-2-methylpyridine

4-(4-butylphenyl)-2-methylpyridine (PubChem CID 154955904) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 4-(4-butylphenyl)-2-methylpyridine.

Molecular Properties

Compound Name4-(4-butylphenyl)-2-methylpyridine
PubChem CID154955904
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name4-(4-butylphenyl)-2-methylpyridine
SMILESCCCCc1ccc(-c2ccnc(C)c2)cc1
InChIInChI=1S/C16H19N/c1-3-4-5-14-6-8-15(9-7-14)16-10-11-17-13(2)12-16/h6-12H,3-5H2,1-2H3
InChIKeyJUXQTEGEOLTMIC-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 ≤ 500225.33
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-butyl-2-methylpyridine;hydrobromide
CID 173184435
2-[4-(4-butylphenyl)phenyl]pyrimidine
CID 57129115
4-(4-butylphenyl)-2,6-dimethylpyrylium
CID 101036687
4-methyl-N-(4-methylphenyl)-N-[4-(2-methyl-4-pyridinyl)phenyl]aniline
CID 146220866
1-butyl-4-(4-ethylphenyl)benzene;ethane
CID 145367281
1-octyl-4-(4-octylphenyl)benzene
CID 22766415
1-(4-butylphenyl)-3-(3,5-diphenylphenyl)-5-phenylbenzene
CID 142551744
2-[3-(4-butylphenyl)phenyl]-5-methylpyridine
CID 140633723
5-(4-butylphenyl)-1,2,3-trimethylbenzene;1,2,3-trimethyl-5-(4-methylphenyl)benzene
CID 123525703
1-butyl-3-(4-pentylphenyl)benzene
CID 123269594
5-(4-butylphenyl)-3-methyl-1,2-oxazole
CID 169499000
6-decyl-2-(6-decylazulen-2-yl)azulene
CID 177425014

Frequently Asked Questions

What is the IUPAC name of 4-(4-butylphenyl)-2-methylpyridine?
The IUPAC name of 4-(4-butylphenyl)-2-methylpyridine (CID 154955904) is 4-(4-butylphenyl)-2-methylpyridine.
What is the SMILES notation for 4-(4-butylphenyl)-2-methylpyridine?
The canonical SMILES for 4-(4-butylphenyl)-2-methylpyridine is CCCCc1ccc(-c2ccnc(C)c2)cc1.
What is the InChIKey of 4-(4-butylphenyl)-2-methylpyridine?
The InChIKey is JUXQTEGEOLTMIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-3-4-5-14-6-8-15(9-7-14)16-10-11-17-13(2)12-16/h6-12H,3-5H2,1-2H3.
What are the key properties of 4-(4-butylphenyl)-2-methylpyridine?
4-(4-butylphenyl)-2-methylpyridine has a molecular weight of 225.33 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 4-(4-butylphenyl)-2-methylpyridine is sourced from PubChem (CID 154955904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).