1-(3,7-dimethyloct-6-enyl)piperidine

C15H29N — CID 3592771

IUPAC1-(3,7-dimethyloct-6-enyl)piperidine
SMILESCC(C)=CCCC(C)CCN1CCCCC1
InChIInChI=1S/C15H29N/c1-14(2)8-7-9-15(3)10-13-16-11-5-4-6-12-16/h8,15H,4-7,9-13H2,1-3H3
InChIKeyIMLLYBOTKNGIAF-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.24
Rot. Bonds6

About 1-(3,7-dimethyloct-6-enyl)piperidine

1-(3,7-dimethyloct-6-enyl)piperidine (PubChem CID 3592771) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-(3,7-dimethyloct-6-enyl)piperidine.

Molecular Properties

Compound Name1-(3,7-dimethyloct-6-enyl)piperidine
PubChem CID3592771
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-(3,7-dimethyloct-6-enyl)piperidine
SMILESCC(C)=CCCC(C)CCN1CCCCC1
InChIInChI=1S/C15H29N/c1-14(2)8-7-9-15(3)10-13-16-11-5-4-6-12-16/h8,15H,4-7,9-13H2,1-3H3
InChIKeyIMLLYBOTKNGIAF-UHFFFAOYSA-N
XLogP4.24
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(3,7-dimethyloct-6-enyl)piperidine?
The IUPAC name of 1-(3,7-dimethyloct-6-enyl)piperidine (CID 3592771) is 1-(3,7-dimethyloct-6-enyl)piperidine.
What is the SMILES notation for 1-(3,7-dimethyloct-6-enyl)piperidine?
The canonical SMILES for 1-(3,7-dimethyloct-6-enyl)piperidine is CC(C)=CCCC(C)CCN1CCCCC1.
What is the InChIKey of 1-(3,7-dimethyloct-6-enyl)piperidine?
The InChIKey is IMLLYBOTKNGIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-14(2)8-7-9-15(3)10-13-16-11-5-4-6-12-16/h8,15H,4-7,9-13H2,1-3H3.
What are the key properties of 1-(3,7-dimethyloct-6-enyl)piperidine?
1-(3,7-dimethyloct-6-enyl)piperidine has a molecular weight of 223.40 g/mol, XLogP of 4.24, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,7-dimethyloct-6-enyl)piperidine is sourced from PubChem (CID 3592771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).