1-decan-4-ylpiperidine

C15H31N — CID 142178259

IUPAC1-decan-4-ylpiperidine
SMILESCCCCCCC(CCC)N1CCCCC1
InChIInChI=1S/C15H31N/c1-3-5-6-8-12-15(11-4-2)16-13-9-7-10-14-16/h15H,3-14H2,1-2H3
InChIKeyUMWPRAOPWHKAIV-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.61
Rot. Bonds8

About 1-decan-4-ylpiperidine

1-decan-4-ylpiperidine (PubChem CID 142178259) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-decan-4-ylpiperidine.

Molecular Properties

Compound Name1-decan-4-ylpiperidine
PubChem CID142178259
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-decan-4-ylpiperidine
SMILESCCCCCCC(CCC)N1CCCCC1
InChIInChI=1S/C15H31N/c1-3-5-6-8-12-15(11-4-2)16-13-9-7-10-14-16/h15H,3-14H2,1-2H3
InChIKeyUMWPRAOPWHKAIV-UHFFFAOYSA-N
XLogP4.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.61
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

1-hexadecan-5-ylpiperidine
CID 175488405
1-undecan-5-ylpiperidine
CID 174506253
1-octan-4-ylazonane
CID 123427772
methane;1-octan-4-ylpiperidine
CID 143122058
1-octadecan-4-ylaziridine
CID 87223215
1-decan-3-ylpiperidine
CID 68984931
1-(23-methyltetracosan-7-yl)pyrrolidine
CID 69388285
1-(18-methylnonadecan-6-yl)pyrrolidine
CID 69395042
1-[(4R)-octan-4-yl]azetidine
CID 170061956
2-(azocan-1-yl)nonan-1-amine
CID 43130470
1-(1-iodononan-2-yl)pyrrolidine
CID 69028048
1-[5,9-bis(azacyclododec-1-yl)-1-[4-(azacyclododec-1-yl)heptyl]nonyl]-azacyclododecane
CID 174384142

Frequently Asked Questions

What is the IUPAC name of 1-decan-4-ylpiperidine?
The IUPAC name of 1-decan-4-ylpiperidine (CID 142178259) is 1-decan-4-ylpiperidine.
What is the SMILES notation for 1-decan-4-ylpiperidine?
The canonical SMILES for 1-decan-4-ylpiperidine is CCCCCCC(CCC)N1CCCCC1.
What is the InChIKey of 1-decan-4-ylpiperidine?
The InChIKey is UMWPRAOPWHKAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-3-5-6-8-12-15(11-4-2)16-13-9-7-10-14-16/h15H,3-14H2,1-2H3.
What are the key properties of 1-decan-4-ylpiperidine?
1-decan-4-ylpiperidine has a molecular weight of 225.42 g/mol, XLogP of 4.61, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decan-4-ylpiperidine is sourced from PubChem (CID 142178259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).