2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine

C13H23NO — CID 143660411

IUPAC2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine
SMILESC=C(OC1CCCC1)C1CCCN1CC
InChIInChI=1S/C13H23NO/c1-3-14-10-6-9-13(14)11(2)15-12-7-4-5-8-12/h12-13H,2-10H2,1H3
InChIKeyFXORRQFUSMNCMX-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.94
Rot. Bonds4

About 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine

2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine (PubChem CID 143660411) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine.

Molecular Properties

Compound Name2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine
PubChem CID143660411
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine
SMILESC=C(OC1CCCC1)C1CCCN1CC
InChIInChI=1S/C13H23NO/c1-3-14-10-6-9-13(14)11(2)15-12-7-4-5-8-12/h12-13H,2-10H2,1H3
InChIKeyFXORRQFUSMNCMX-UHFFFAOYSA-N
XLogP2.94
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
The IUPAC name of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine (CID 143660411) is 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine.
What is the SMILES notation for 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
The canonical SMILES for 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine is C=C(OC1CCCC1)C1CCCN1CC.
What is the InChIKey of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
The InChIKey is FXORRQFUSMNCMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-3-14-10-6-9-13(14)11(2)15-12-7-4-5-8-12/h12-13H,2-10H2,1H3.
What are the key properties of 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine?
2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine has a molecular weight of 209.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentyloxyethenyl)-1-ethylpyrrolidine is sourced from PubChem (CID 143660411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).