2,5-bis(ethenyl)piperidine

C9H15N — CID 121255196

IUPAC2,5-bis(ethenyl)piperidine
SMILESC=CC1CCC(C=C)NC1
InChIInChI=1S/C9H15N/c1-3-8-5-6-9(4-2)10-7-8/h3-4,8-10H,1-2,5-7H2
InChIKeySWBKMWFBCBHBHD-UHFFFAOYSA-N
MW137.23 g/mol
LogP1.73
Rot. Bonds2

About 2,5-bis(ethenyl)piperidine

2,5-bis(ethenyl)piperidine (PubChem CID 121255196) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 2,5-bis(ethenyl)piperidine.

Molecular Properties

Compound Name2,5-bis(ethenyl)piperidine
PubChem CID121255196
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name2,5-bis(ethenyl)piperidine
SMILESC=CC1CCC(C=C)NC1
InChIInChI=1S/C9H15N/c1-3-8-5-6-9(4-2)10-7-8/h3-4,8-10H,1-2,5-7H2
InChIKeySWBKMWFBCBHBHD-UHFFFAOYSA-N
XLogP1.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 51.73
H-Bond Donors ≤ 51
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 2,5-bis(ethenyl)piperidine?
The IUPAC name of 2,5-bis(ethenyl)piperidine (CID 121255196) is 2,5-bis(ethenyl)piperidine.
What is the SMILES notation for 2,5-bis(ethenyl)piperidine?
The canonical SMILES for 2,5-bis(ethenyl)piperidine is C=CC1CCC(C=C)NC1.
What is the InChIKey of 2,5-bis(ethenyl)piperidine?
The InChIKey is SWBKMWFBCBHBHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-3-8-5-6-9(4-2)10-7-8/h3-4,8-10H,1-2,5-7H2.
What are the key properties of 2,5-bis(ethenyl)piperidine?
2,5-bis(ethenyl)piperidine has a molecular weight of 137.23 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(ethenyl)piperidine is sourced from PubChem (CID 121255196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).