2-(5-methyloct-4-enyl)pyridine

C14H21N — CID 123569284

IUPAC2-(5-methyloct-4-enyl)pyridine
SMILESCCCC(C)=CCCCc1ccccn1
InChIInChI=1S/C14H21N/c1-3-8-13(2)9-4-5-10-14-11-6-7-12-15-14/h6-7,9,11-12H,3-5,8,10H2,1-2H3
InChIKeyMMZXOVMSYRDAKP-UHFFFAOYSA-N
MW203.33 g/mol
LogP4.15
Rot. Bonds6

About 2-(5-methyloct-4-enyl)pyridine

2-(5-methyloct-4-enyl)pyridine (PubChem CID 123569284) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-(5-methyloct-4-enyl)pyridine.

Molecular Properties

Compound Name2-(5-methyloct-4-enyl)pyridine
PubChem CID123569284
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-(5-methyloct-4-enyl)pyridine
SMILESCCCC(C)=CCCCc1ccccn1
InChIInChI=1S/C14H21N/c1-3-8-13(2)9-4-5-10-14-11-6-7-12-15-14/h6-7,9,11-12H,3-5,8,10H2,1-2H3
InChIKeyMMZXOVMSYRDAKP-UHFFFAOYSA-N
XLogP4.15
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[(Z)-5-methoxyhex-4-enyl]pyridine
CID 14312400
2-hex-4-enylpyridine
CID 174507430
2-undecylpyridine
CID 66882765
chromium;2-pentylpyridine;hydrochloride
CID 175220071
2-tetradecylpyridine;hydrochloride
CID 45489746
2-hexadecylpyridine;hydrate
CID 141211108
azanium;2-tetradecylpyridine;bromide
CID 157411341
2-(14-pyridin-2-yltetradecyl)pyridine
CID 10594187
acetic acid;2-propylpyridine;hydrobromide
CID 70094168
4-pyridin-2-ylbutan-1-imine
CID 91482132
hydroxymethanone;2-undecylpyridine;zinc
CID 87363330
5-pyridin-2-ylpentanal
CID 13416615

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyloct-4-enyl)pyridine?
The IUPAC name of 2-(5-methyloct-4-enyl)pyridine (CID 123569284) is 2-(5-methyloct-4-enyl)pyridine.
What is the SMILES notation for 2-(5-methyloct-4-enyl)pyridine?
The canonical SMILES for 2-(5-methyloct-4-enyl)pyridine is CCCC(C)=CCCCc1ccccn1.
What is the InChIKey of 2-(5-methyloct-4-enyl)pyridine?
The InChIKey is MMZXOVMSYRDAKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-8-13(2)9-4-5-10-14-11-6-7-12-15-14/h6-7,9,11-12H,3-5,8,10H2,1-2H3.
What are the key properties of 2-(5-methyloct-4-enyl)pyridine?
2-(5-methyloct-4-enyl)pyridine has a molecular weight of 203.33 g/mol, XLogP of 4.15, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyloct-4-enyl)pyridine is sourced from PubChem (CID 123569284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).