4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine

C12H22N2O — CID 70256997

IUPAC4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine
SMILESC=C(COC1CCNCC1)N1CCCC1
InChIInChI=1S/C12H22N2O/c1-11(14-8-2-3-9-14)10-15-12-4-6-13-7-5-12/h12-13H,1-10H2
InChIKeyJARAWZYRSLJNHD-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.36
Rot. Bonds4

About 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine

4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine (PubChem CID 70256997) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine.

Molecular Properties

Compound Name4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine
PubChem CID70256997
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine
SMILESC=C(COC1CCNCC1)N1CCCC1
InChIInChI=1S/C12H22N2O/c1-11(14-8-2-3-9-14)10-15-12-4-6-13-7-5-12/h12-13H,1-10H2
InChIKeyJARAWZYRSLJNHD-UHFFFAOYSA-N
XLogP1.36
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine?
The IUPAC name of 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine (CID 70256997) is 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine.
What is the SMILES notation for 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine?
The canonical SMILES for 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine is C=C(COC1CCNCC1)N1CCCC1.
What is the InChIKey of 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine?
The InChIKey is JARAWZYRSLJNHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-11(14-8-2-3-9-14)10-15-12-4-6-13-7-5-12/h12-13H,1-10H2.
What are the key properties of 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine?
4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine has a molecular weight of 210.32 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-pyrrolidin-1-ylprop-2-enoxy)piperidine is sourced from PubChem (CID 70256997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).