1-(1-piperidin-1-ylbut-2-enyl)piperidine

C14H26N2 — CID 70026639

IUPAC1-(1-piperidin-1-ylbut-2-enyl)piperidine
SMILESCC=CC(N1CCCCC1)N1CCCCC1
InChIInChI=1S/C14H26N2/c1-2-9-14(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h2,9,14H,3-8,10-13H2,1H3
InChIKeyUBMMMDJWWVDWGT-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.86
Rot. Bonds3

About 1-(1-piperidin-1-ylbut-2-enyl)piperidine

1-(1-piperidin-1-ylbut-2-enyl)piperidine (PubChem CID 70026639) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 1-(1-piperidin-1-ylbut-2-enyl)piperidine.

Molecular Properties

Compound Name1-(1-piperidin-1-ylbut-2-enyl)piperidine
PubChem CID70026639
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name1-(1-piperidin-1-ylbut-2-enyl)piperidine
SMILESCC=CC(N1CCCCC1)N1CCCCC1
InChIInChI=1S/C14H26N2/c1-2-9-14(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h2,9,14H,3-8,10-13H2,1H3
InChIKeyUBMMMDJWWVDWGT-UHFFFAOYSA-N
XLogP2.86
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(1-piperidin-1-ylbut-2-enyl)piperidine?
The IUPAC name of 1-(1-piperidin-1-ylbut-2-enyl)piperidine (CID 70026639) is 1-(1-piperidin-1-ylbut-2-enyl)piperidine.
What is the SMILES notation for 1-(1-piperidin-1-ylbut-2-enyl)piperidine?
The canonical SMILES for 1-(1-piperidin-1-ylbut-2-enyl)piperidine is CC=CC(N1CCCCC1)N1CCCCC1.
What is the InChIKey of 1-(1-piperidin-1-ylbut-2-enyl)piperidine?
The InChIKey is UBMMMDJWWVDWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-2-9-14(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h2,9,14H,3-8,10-13H2,1H3.
What are the key properties of 1-(1-piperidin-1-ylbut-2-enyl)piperidine?
1-(1-piperidin-1-ylbut-2-enyl)piperidine has a molecular weight of 222.38 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-piperidin-1-ylbut-2-enyl)piperidine is sourced from PubChem (CID 70026639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).