2-(2-octylphenyl)pyridine

C19H25N — CID 15643012

IUPAC2-(2-octylphenyl)pyridine
SMILESCCCCCCCCc1ccccc1-c1ccccn1
InChIInChI=1S/C19H25N/c1-2-3-4-5-6-7-12-17-13-8-9-14-18(17)19-15-10-11-16-20-19/h8-11,13-16H,2-7,12H2,1H3
InChIKeyFRNVQRPLDGBTHA-UHFFFAOYSA-N
MW267.42 g/mol
LogP5.65
Rot. Bonds8

About 2-(2-octylphenyl)pyridine

2-(2-octylphenyl)pyridine (PubChem CID 15643012) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(2-octylphenyl)pyridine.

Molecular Properties

Compound Name2-(2-octylphenyl)pyridine
PubChem CID15643012
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name2-(2-octylphenyl)pyridine
SMILESCCCCCCCCc1ccccc1-c1ccccn1
InChIInChI=1S/C19H25N/c1-2-3-4-5-6-7-12-17-13-8-9-14-18(17)19-15-10-11-16-20-19/h8-11,13-16H,2-7,12H2,1H3
InChIKeyFRNVQRPLDGBTHA-UHFFFAOYSA-N
XLogP5.65
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.42
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-butylphenyl)pyridine
CID 11977286
2-pyridin-2-yl-3-tetradecylpyridine
CID 69057571
2-(3-butyl-2-methylphenyl)pyridine
CID 161168281
2-(2-pyridin-2-ylphenyl)ethanamine
CID 22356817
3,4-di(nonadecyl)-2-pyridin-2-ylpyridine
CID 164513177
2-chloro-3-dodecylpyridine
CID 54546812
2-chloro-3-hexylpyridine
CID 54056214
1,2-di(undecyl)benzene
CID 3019479
1-dodecyl-2-hexylbenzene
CID 19371073
1-nonyl-2-pentylbenzene
CID 54050070
1-hexadecyl-2-pentylbenzene
CID 53438584
1,2-di(nonadecyl)benzene
CID 101289987

Frequently Asked Questions

What is the IUPAC name of 2-(2-octylphenyl)pyridine?
The IUPAC name of 2-(2-octylphenyl)pyridine (CID 15643012) is 2-(2-octylphenyl)pyridine.
What is the SMILES notation for 2-(2-octylphenyl)pyridine?
The canonical SMILES for 2-(2-octylphenyl)pyridine is CCCCCCCCc1ccccc1-c1ccccn1.
What is the InChIKey of 2-(2-octylphenyl)pyridine?
The InChIKey is FRNVQRPLDGBTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-2-3-4-5-6-7-12-17-13-8-9-14-18(17)19-15-10-11-16-20-19/h8-11,13-16H,2-7,12H2,1H3.
What are the key properties of 2-(2-octylphenyl)pyridine?
2-(2-octylphenyl)pyridine has a molecular weight of 267.42 g/mol, XLogP of 5.65, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-octylphenyl)pyridine is sourced from PubChem (CID 15643012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).