2-(2-chlorononyl)pyridine

C14H22ClN — CID 66459167

IUPAC2-(2-chlorononyl)pyridine
SMILESCCCCCCCC(Cl)Cc1ccccn1
InChIInChI=1S/C14H22ClN/c1-2-3-4-5-6-9-13(15)12-14-10-7-8-11-16-14/h7-8,10-11,13H,2-6,9,12H2,1H3
InChIKeyIQQRIPIMQDOIKA-UHFFFAOYSA-N
MW239.79 g/mol
LogP4.59
Rot. Bonds8

About 2-(2-chlorononyl)pyridine

2-(2-chlorononyl)pyridine (PubChem CID 66459167) has the molecular formula C14H22ClN and a molecular weight of 239.79 g/mol. Its IUPAC name is 2-(2-chlorononyl)pyridine.

Molecular Properties

Compound Name2-(2-chlorononyl)pyridine
PubChem CID66459167
Molecular FormulaC14H22ClN
Molecular Weight239.79 g/mol
Exact Mass239.14
IUPAC Name2-(2-chlorononyl)pyridine
SMILESCCCCCCCC(Cl)Cc1ccccn1
InChIInChI=1S/C14H22ClN/c1-2-3-4-5-6-9-13(15)12-14-10-7-8-11-16-14/h7-8,10-11,13H,2-6,9,12H2,1H3
InChIKeyIQQRIPIMQDOIKA-UHFFFAOYSA-N
XLogP4.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.79
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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2-(2-cyclopentyloctyl)pyridine
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2-undecylpyridine
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2-hexadecylpyridine;hydrate
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2-tetradecylpyridine;hydrochloride
CID 45489746
2-(3-methyloctyl)pyridine;hydrochloride
CID 172780204
azanium;2-tetradecylpyridine;bromide
CID 157411341
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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorononyl)pyridine?
The IUPAC name of 2-(2-chlorononyl)pyridine (CID 66459167) is 2-(2-chlorononyl)pyridine.
What is the SMILES notation for 2-(2-chlorononyl)pyridine?
The canonical SMILES for 2-(2-chlorononyl)pyridine is CCCCCCCC(Cl)Cc1ccccn1.
What is the InChIKey of 2-(2-chlorononyl)pyridine?
The InChIKey is IQQRIPIMQDOIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN/c1-2-3-4-5-6-9-13(15)12-14-10-7-8-11-16-14/h7-8,10-11,13H,2-6,9,12H2,1H3.
What are the key properties of 2-(2-chlorononyl)pyridine?
2-(2-chlorononyl)pyridine has a molecular weight of 239.79 g/mol, XLogP of 4.59, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorononyl)pyridine is sourced from PubChem (CID 66459167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).