1-dodec-11-enylpiperidine

C17H33N — CID 134900809

IUPAC1-dodec-11-enylpiperidine
SMILESC=CCCCCCCCCCCN1CCCCC1
InChIInChI=1S/C17H33N/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18/h2H,1,3-17H2
InChIKeyHBQDFHQZHVINJZ-UHFFFAOYSA-N
MW251.46 g/mol
LogP5.17
Rot. Bonds11

About 1-dodec-11-enylpiperidine

1-dodec-11-enylpiperidine (PubChem CID 134900809) has the molecular formula C17H33N and a molecular weight of 251.46 g/mol. Its IUPAC name is 1-dodec-11-enylpiperidine.

Molecular Properties

Compound Name1-dodec-11-enylpiperidine
PubChem CID134900809
Molecular FormulaC17H33N
Molecular Weight251.46 g/mol
Exact Mass251.26
IUPAC Name1-dodec-11-enylpiperidine
SMILESC=CCCCCCCCCCCN1CCCCC1
InChIInChI=1S/C17H33N/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18/h2H,1,3-17H2
InChIKeyHBQDFHQZHVINJZ-UHFFFAOYSA-N
XLogP5.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500251.46
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-dodec-11-enylpiperidine?
The IUPAC name of 1-dodec-11-enylpiperidine (CID 134900809) is 1-dodec-11-enylpiperidine.
What is the SMILES notation for 1-dodec-11-enylpiperidine?
The canonical SMILES for 1-dodec-11-enylpiperidine is C=CCCCCCCCCCCN1CCCCC1.
What is the InChIKey of 1-dodec-11-enylpiperidine?
The InChIKey is HBQDFHQZHVINJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18/h2H,1,3-17H2.
What are the key properties of 1-dodec-11-enylpiperidine?
1-dodec-11-enylpiperidine has a molecular weight of 251.46 g/mol, XLogP of 5.17, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dodec-11-enylpiperidine is sourced from PubChem (CID 134900809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).