1-nonyl-4-piperidin-4-ylpiperidine

C19H38N2 — CID 44592884

IUPAC1-nonyl-4-piperidin-4-ylpiperidine
SMILESCCCCCCCCCN1CCC(C2CCNCC2)CC1
InChIInChI=1S/C19H38N2/c1-2-3-4-5-6-7-8-15-21-16-11-19(12-17-21)18-9-13-20-14-10-18/h18-20H,2-17H2,1H3
InChIKeyPDBMQDREULSRRK-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.45
Rot. Bonds9

About 1-nonyl-4-piperidin-4-ylpiperidine

1-nonyl-4-piperidin-4-ylpiperidine (PubChem CID 44592884) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 1-nonyl-4-piperidin-4-ylpiperidine.

Molecular Properties

Compound Name1-nonyl-4-piperidin-4-ylpiperidine
PubChem CID44592884
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name1-nonyl-4-piperidin-4-ylpiperidine
SMILESCCCCCCCCCN1CCC(C2CCNCC2)CC1
InChIInChI=1S/C19H38N2/c1-2-3-4-5-6-7-8-15-21-16-11-19(12-17-21)18-9-13-20-14-10-18/h18-20H,2-17H2,1H3
InChIKeyPDBMQDREULSRRK-UHFFFAOYSA-N
XLogP4.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.45
H-Bond Donors ≤ 51
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 1-nonyl-4-piperidin-4-ylpiperidine?
The IUPAC name of 1-nonyl-4-piperidin-4-ylpiperidine (CID 44592884) is 1-nonyl-4-piperidin-4-ylpiperidine.
What is the SMILES notation for 1-nonyl-4-piperidin-4-ylpiperidine?
The canonical SMILES for 1-nonyl-4-piperidin-4-ylpiperidine is CCCCCCCCCN1CCC(C2CCNCC2)CC1.
What is the InChIKey of 1-nonyl-4-piperidin-4-ylpiperidine?
The InChIKey is PDBMQDREULSRRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-2-3-4-5-6-7-8-15-21-16-11-19(12-17-21)18-9-13-20-14-10-18/h18-20H,2-17H2,1H3.
What are the key properties of 1-nonyl-4-piperidin-4-ylpiperidine?
1-nonyl-4-piperidin-4-ylpiperidine has a molecular weight of 294.53 g/mol, XLogP of 4.45, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nonyl-4-piperidin-4-ylpiperidine is sourced from PubChem (CID 44592884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).