1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine

C18H33N — CID 14764803

IUPAC1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine
SMILESCC(C)=CCC/C(C)=C/CCC(C)N1CCCCC1
InChIInChI=1S/C18H33N/c1-16(2)10-8-11-17(3)12-9-13-18(4)19-14-6-5-7-15-19/h10,12,18H,5-9,11,13-15H2,1-4H3/b17-12+
InChIKeyWOVQHYQAJNBCIA-SFQUDFHCSA-N
MW263.47 g/mol
LogP5.33
Rot. Bonds7

About 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine

1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine (PubChem CID 14764803) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine.

Molecular Properties

Compound Name1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine
PubChem CID14764803
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC Name1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine
SMILESCC(C)=CCC/C(C)=C/CCC(C)N1CCCCC1
InChIInChI=1S/C18H33N/c1-16(2)10-8-11-17(3)12-9-13-18(4)19-14-6-5-7-15-19/h10,12,18H,5-9,11,13-15H2,1-4H3/b17-12+
InChIKeyWOVQHYQAJNBCIA-SFQUDFHCSA-N
XLogP5.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.47
LogP ≤ 55.33
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-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine?
The IUPAC name of 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine (CID 14764803) is 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine.
What is the SMILES notation for 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine?
The canonical SMILES for 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine is CC(C)=CCC/C(C)=C/CCC(C)N1CCCCC1.
What is the InChIKey of 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine?
The InChIKey is WOVQHYQAJNBCIA-SFQUDFHCSA-N. The full InChI is InChI=1S/C18H33N/c1-16(2)10-8-11-17(3)12-9-13-18(4)19-14-6-5-7-15-19/h10,12,18H,5-9,11,13-15H2,1-4H3/b17-12+.
What are the key properties of 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine?
1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine has a molecular weight of 263.47 g/mol, XLogP of 5.33, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5E)-6,10-dimethylundeca-5,9-dien-2-yl]piperidine is sourced from PubChem (CID 14764803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).