2-heptyl-6-piperidin-1-ylpyridine

C17H28N2 — CID 14570979

IUPAC2-heptyl-6-piperidin-1-ylpyridine
SMILESCCCCCCCc1cccc(N2CCCCC2)n1
InChIInChI=1S/C17H28N2/c1-2-3-4-5-7-11-16-12-10-13-17(18-16)19-14-8-6-9-15-19/h10,12-13H,2-9,11,14-15H2,1H3
InChIKeyYVHVJLPVKUCQPV-UHFFFAOYSA-N
MW260.42 g/mol
LogP4.58
Rot. Bonds7

About 2-heptyl-6-piperidin-1-ylpyridine

2-heptyl-6-piperidin-1-ylpyridine (PubChem CID 14570979) has the molecular formula C17H28N2 and a molecular weight of 260.42 g/mol. Its IUPAC name is 2-heptyl-6-piperidin-1-ylpyridine.

Molecular Properties

Compound Name2-heptyl-6-piperidin-1-ylpyridine
PubChem CID14570979
Molecular FormulaC17H28N2
Molecular Weight260.42 g/mol
Exact Mass260.23
IUPAC Name2-heptyl-6-piperidin-1-ylpyridine
SMILESCCCCCCCc1cccc(N2CCCCC2)n1
InChIInChI=1S/C17H28N2/c1-2-3-4-5-7-11-16-12-10-13-17(18-16)19-14-8-6-9-15-19/h10,12-13H,2-9,11,14-15H2,1H3
InChIKeyYVHVJLPVKUCQPV-UHFFFAOYSA-N
XLogP4.58
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-heptyl-6-piperidin-1-ylpyridine?
The IUPAC name of 2-heptyl-6-piperidin-1-ylpyridine (CID 14570979) is 2-heptyl-6-piperidin-1-ylpyridine.
What is the SMILES notation for 2-heptyl-6-piperidin-1-ylpyridine?
The canonical SMILES for 2-heptyl-6-piperidin-1-ylpyridine is CCCCCCCc1cccc(N2CCCCC2)n1.
What is the InChIKey of 2-heptyl-6-piperidin-1-ylpyridine?
The InChIKey is YVHVJLPVKUCQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-2-3-4-5-7-11-16-12-10-13-17(18-16)19-14-8-6-9-15-19/h10,12-13H,2-9,11,14-15H2,1H3.
What are the key properties of 2-heptyl-6-piperidin-1-ylpyridine?
2-heptyl-6-piperidin-1-ylpyridine has a molecular weight of 260.42 g/mol, XLogP of 4.58, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-heptyl-6-piperidin-1-ylpyridine is sourced from PubChem (CID 14570979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).