3-(2-prop-2-enoxyethoxy)piperidine

C10H19NO2 — CID 53409512

IUPAC3-(2-prop-2-enoxyethoxy)piperidine
SMILESC=CCOCCOC1CCCNC1
InChIInChI=1S/C10H19NO2/c1-2-6-12-7-8-13-10-4-3-5-11-9-10/h2,10-11H,1,3-9H2
InChIKeyMHNMMXZNBIXISY-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.96
Rot. Bonds6

About 3-(2-prop-2-enoxyethoxy)piperidine

3-(2-prop-2-enoxyethoxy)piperidine (PubChem CID 53409512) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 3-(2-prop-2-enoxyethoxy)piperidine.

Molecular Properties

Compound Name3-(2-prop-2-enoxyethoxy)piperidine
PubChem CID53409512
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name3-(2-prop-2-enoxyethoxy)piperidine
SMILESC=CCOCCOC1CCCNC1
InChIInChI=1S/C10H19NO2/c1-2-6-12-7-8-13-10-4-3-5-11-9-10/h2,10-11H,1,3-9H2
InChIKeyMHNMMXZNBIXISY-UHFFFAOYSA-N
XLogP0.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-(2-prop-2-enoxyethoxy)piperidine?
The IUPAC name of 3-(2-prop-2-enoxyethoxy)piperidine (CID 53409512) is 3-(2-prop-2-enoxyethoxy)piperidine.
What is the SMILES notation for 3-(2-prop-2-enoxyethoxy)piperidine?
The canonical SMILES for 3-(2-prop-2-enoxyethoxy)piperidine is C=CCOCCOC1CCCNC1.
What is the InChIKey of 3-(2-prop-2-enoxyethoxy)piperidine?
The InChIKey is MHNMMXZNBIXISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-6-12-7-8-13-10-4-3-5-11-9-10/h2,10-11H,1,3-9H2.
What are the key properties of 3-(2-prop-2-enoxyethoxy)piperidine?
3-(2-prop-2-enoxyethoxy)piperidine has a molecular weight of 185.27 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-prop-2-enoxyethoxy)piperidine is sourced from PubChem (CID 53409512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).