2-(2-cyclopentyloctyl)pyridine

C18H29N — CID 57318579

IUPAC2-(2-cyclopentyloctyl)pyridine
SMILESCCCCCCC(Cc1ccccn1)C1CCCC1
InChIInChI=1S/C18H29N/c1-2-3-4-5-12-17(16-10-6-7-11-16)15-18-13-8-9-14-19-18/h8-9,13-14,16-17H,2-7,10-12,15H2,1H3
InChIKeySDXSSCVDKOWDMW-UHFFFAOYSA-N
MW259.44 g/mol
LogP5.40
Rot. Bonds8

About 2-(2-cyclopentyloctyl)pyridine

2-(2-cyclopentyloctyl)pyridine (PubChem CID 57318579) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 2-(2-cyclopentyloctyl)pyridine.

Molecular Properties

Compound Name2-(2-cyclopentyloctyl)pyridine
PubChem CID57318579
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name2-(2-cyclopentyloctyl)pyridine
SMILESCCCCCCC(Cc1ccccn1)C1CCCC1
InChIInChI=1S/C18H29N/c1-2-3-4-5-12-17(16-10-6-7-11-16)15-18-13-8-9-14-19-18/h8-9,13-14,16-17H,2-7,10-12,15H2,1H3
InChIKeySDXSSCVDKOWDMW-UHFFFAOYSA-N
XLogP5.40
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.44
LogP ≤ 55.40
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-bromodecyl)pyridine
CID 66452883
2-(2-chlorononyl)pyridine
CID 66459167
hexadecan-8-ylcyclohexane
CID 91510029
1-cyclohexyl-N-methyl-2-pyridin-2-ylethanamine
CID 60819908
2-(pyridin-2-ylmethyl)heptanenitrile
CID 67860506
undecan-5-ylcyclohexane
CID 524419
nonan-3-ylcyclopentane
CID 19893531
2-undecylpyridine
CID 66882765
N-(pyridin-2-ylmethyl)octan-2-amine
CID 43085262
3-(2-cyclopropylheptyl)pyridine
CID 57314652
1-cyclopropyl-N-methyl-2-pyridin-2-ylethanamine
CID 63352689
1-bromodecan-2-ylcyclopentane
CID 112570528

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentyloctyl)pyridine?
The IUPAC name of 2-(2-cyclopentyloctyl)pyridine (CID 57318579) is 2-(2-cyclopentyloctyl)pyridine.
What is the SMILES notation for 2-(2-cyclopentyloctyl)pyridine?
The canonical SMILES for 2-(2-cyclopentyloctyl)pyridine is CCCCCCC(Cc1ccccn1)C1CCCC1.
What is the InChIKey of 2-(2-cyclopentyloctyl)pyridine?
The InChIKey is SDXSSCVDKOWDMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-2-3-4-5-12-17(16-10-6-7-11-16)15-18-13-8-9-14-19-18/h8-9,13-14,16-17H,2-7,10-12,15H2,1H3.
What are the key properties of 2-(2-cyclopentyloctyl)pyridine?
2-(2-cyclopentyloctyl)pyridine has a molecular weight of 259.44 g/mol, XLogP of 5.40, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentyloctyl)pyridine is sourced from PubChem (CID 57318579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).