1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine

C13H23N — CID 155329325

IUPAC1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine
SMILESCCC1CCN(/C=C/C2CCCC2)C1
InChIInChI=1S/C13H23N/c1-2-12-7-9-14(11-12)10-8-13-5-3-4-6-13/h8,10,12-13H,2-7,9,11H2,1H3/b10-8+
InChIKeyRVFUZUZAXCDVOD-CSKARUKUSA-N
MW193.33 g/mol
LogP3.42
Rot. Bonds3

About 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine

1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine (PubChem CID 155329325) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine.

Molecular Properties

Compound Name1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine
PubChem CID155329325
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine
SMILESCCC1CCN(/C=C/C2CCCC2)C1
InChIInChI=1S/C13H23N/c1-2-12-7-9-14(11-12)10-8-13-5-3-4-6-13/h8,10,12-13H,2-7,9,11H2,1H3/b10-8+
InChIKeyRVFUZUZAXCDVOD-CSKARUKUSA-N
XLogP3.42
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine?
The IUPAC name of 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine (CID 155329325) is 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine.
What is the SMILES notation for 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine?
The canonical SMILES for 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine is CCC1CCN(/C=C/C2CCCC2)C1.
What is the InChIKey of 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine?
The InChIKey is RVFUZUZAXCDVOD-CSKARUKUSA-N. The full InChI is InChI=1S/C13H23N/c1-2-12-7-9-14(11-12)10-8-13-5-3-4-6-13/h8,10,12-13H,2-7,9,11H2,1H3/b10-8+.
What are the key properties of 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine?
1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine has a molecular weight of 193.33 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-cyclopentylethenyl]-3-ethylpyrrolidine is sourced from PubChem (CID 155329325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).