1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine

C13H24N2 — CID 21499135

IUPAC1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine
SMILESC/C(=C\N1CCCCC1)N1CCCCC1
InChIInChI=1S/C13H24N2/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h12H,2-11H2,1H3/b13-12+
InChIKeyDALVWVIDKYPQGM-OUKQBFOZSA-N
MW208.35 g/mol
LogP2.82
Rot. Bonds2

About 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine

1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine (PubChem CID 21499135) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine.

Molecular Properties

Compound Name1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine
PubChem CID21499135
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine
SMILESC/C(=C\N1CCCCC1)N1CCCCC1
InChIInChI=1S/C13H24N2/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h12H,2-11H2,1H3/b13-12+
InChIKeyDALVWVIDKYPQGM-OUKQBFOZSA-N
XLogP2.82
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine?
The IUPAC name of 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine (CID 21499135) is 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine.
What is the SMILES notation for 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine?
The canonical SMILES for 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine is C/C(=C\N1CCCCC1)N1CCCCC1.
What is the InChIKey of 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine?
The InChIKey is DALVWVIDKYPQGM-OUKQBFOZSA-N. The full InChI is InChI=1S/C13H24N2/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h12H,2-11H2,1H3/b13-12+.
What are the key properties of 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine?
1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine has a molecular weight of 208.35 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-1-piperidin-1-ylprop-1-en-2-yl]piperidine is sourced from PubChem (CID 21499135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).