1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine

C10H21NO2 — CID 68592080

IUPAC1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine
SMILESCCOC(C)OC(C)N1CCCC1
InChIInChI=1S/C10H21NO2/c1-4-12-10(3)13-9(2)11-7-5-6-8-11/h9-10H,4-8H2,1-3H3
InChIKeyFKYIELCZJCNCIA-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.83
Rot. Bonds5

About 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine

1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine (PubChem CID 68592080) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine.

Molecular Properties

Compound Name1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine
PubChem CID68592080
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine
SMILESCCOC(C)OC(C)N1CCCC1
InChIInChI=1S/C10H21NO2/c1-4-12-10(3)13-9(2)11-7-5-6-8-11/h9-10H,4-8H2,1-3H3
InChIKeyFKYIELCZJCNCIA-UHFFFAOYSA-N
XLogP1.83
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine?
The IUPAC name of 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine (CID 68592080) is 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine.
What is the SMILES notation for 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine?
The canonical SMILES for 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine is CCOC(C)OC(C)N1CCCC1.
What is the InChIKey of 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine?
The InChIKey is FKYIELCZJCNCIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-4-12-10(3)13-9(2)11-7-5-6-8-11/h9-10H,4-8H2,1-3H3.
What are the key properties of 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine?
1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine has a molecular weight of 187.28 g/mol, XLogP of 1.83, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-ethoxyethoxy)ethyl]pyrrolidine is sourced from PubChem (CID 68592080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).