2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine

C12H23NO2 — CID 56830009

IUPAC2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine
SMILESC=CCOCCOCCC1CCCCN1
InChIInChI=1S/C12H23NO2/c1-2-8-14-10-11-15-9-6-12-5-3-4-7-13-12/h2,12-13H,1,3-11H2
InChIKeyMEGXHGMYHLTZOF-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.74
Rot. Bonds8

About 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine

2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine (PubChem CID 56830009) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine.

Molecular Properties

Compound Name2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine
PubChem CID56830009
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine
SMILESC=CCOCCOCCC1CCCCN1
InChIInChI=1S/C12H23NO2/c1-2-8-14-10-11-15-9-6-12-5-3-4-7-13-12/h2,12-13H,1,3-11H2
InChIKeyMEGXHGMYHLTZOF-UHFFFAOYSA-N
XLogP1.74
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.74
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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Related Compounds

(2R)-2-(prop-2-enoxymethyl)piperidine
CID 94403249
2-(2-Pent-4-enoxyethyl)piperidine
CID 53408887
2-[2-(Allyloxy)ethyl]piperidine hydrochloride
CID 53408893
2-(2-Prop-2-enoxyethyl)piperidine
CID 53408894
2-{2-[(2-Methyl-2-propenyl)oxy]ethyl}piperidine hydrochloride
CID 56830000
2-[2-(2-Methylprop-2-enoxy)ethyl]piperidine
CID 56830001
2-{2-[2-(Allyloxy)ethoxy]ethyl}piperidine hydrochloride
CID 56830008
2-(Prop-2-enoxymethyl)piperidine
CID 62341272
2-[2-(2-Bromoprop-2-enoxy)ethyl]piperidine
CID 62341417
2-[2-(3-Methylbut-2-enoxy)ethyl]piperidine
CID 62341606
2-[2-(2-Chloroprop-2-enoxy)ethyl]piperidine
CID 62341810
2-(2-But-3-en-2-yloxyethyl)piperidine
CID 62382319

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine?
The IUPAC name of 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine (CID 56830009) is 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine.
What is the SMILES notation for 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine?
The canonical SMILES for 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine is C=CCOCCOCCC1CCCCN1.
What is the InChIKey of 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine?
The InChIKey is MEGXHGMYHLTZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-2-8-14-10-11-15-9-6-12-5-3-4-7-13-12/h2,12-13H,1,3-11H2.
What are the key properties of 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine?
2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine has a molecular weight of 213.32 g/mol, XLogP of 1.74, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-prop-2-enoxyethoxy)ethyl]piperidine is sourced from PubChem (CID 56830009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).