3-ethenyl-1-ethylpyrrolidine

C8H15N — CID 150632984

IUPAC3-ethenyl-1-ethylpyrrolidine
SMILESC=CC1CCN(CC)C1
InChIInChI=1S/C8H15N/c1-3-8-5-6-9(4-2)7-8/h3,8H,1,4-7H2,2H3
InChIKeyIYHATTDHDMDPDM-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.51
Rot. Bonds2

About 3-ethenyl-1-ethylpyrrolidine

3-ethenyl-1-ethylpyrrolidine (PubChem CID 150632984) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 3-ethenyl-1-ethylpyrrolidine.

Molecular Properties

Compound Name3-ethenyl-1-ethylpyrrolidine
PubChem CID150632984
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name3-ethenyl-1-ethylpyrrolidine
SMILESC=CC1CCN(CC)C1
InChIInChI=1S/C8H15N/c1-3-8-5-6-9(4-2)7-8/h3,8H,1,4-7H2,2H3
InChIKeyIYHATTDHDMDPDM-UHFFFAOYSA-N
XLogP1.51
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(3-Butenyl)pyrrolidine
CID 250707
1-(4-Pentenyl)pyrrolidine
CID 558404
(E)-1-(3-methylbut-1-en-1-yl)pyrrolidine
CID 10866408
5-(N,N-diisobutylamino)-1-pentene
CID 88291345
(3R,4R)-3-ethenyl-4-fluoro-1-methylpyrrolidine
CID 144716687
3-Ethenyl-3-fluoro-1-methylpyrrolidine
CID 152894318
(3R)-3-ethenyl-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 165136249
4-Ethenyl-3,3-difluoro-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 170602636
(3R)-3-ethenyl-3-fluoro-1-(2-methylpropyl)pyrrolidine
CID 177368001
N,N-dimethyl-2-prop-2-enylnona-3,4,8-trien-1-amine
CID 12715945
(2S,3S)-2,3-dimethyl-1-pyrrolidin-1-ylpent-4-ene-1-selone
CID 15415999
2-Methyl-1-pyrrolidin-1-ylpent-4-ene-1-selone
CID 15416001

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-1-ethylpyrrolidine?
The IUPAC name of 3-ethenyl-1-ethylpyrrolidine (CID 150632984) is 3-ethenyl-1-ethylpyrrolidine.
What is the SMILES notation for 3-ethenyl-1-ethylpyrrolidine?
The canonical SMILES for 3-ethenyl-1-ethylpyrrolidine is C=CC1CCN(CC)C1.
What is the InChIKey of 3-ethenyl-1-ethylpyrrolidine?
The InChIKey is IYHATTDHDMDPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-3-8-5-6-9(4-2)7-8/h3,8H,1,4-7H2,2H3.
What are the key properties of 3-ethenyl-1-ethylpyrrolidine?
3-ethenyl-1-ethylpyrrolidine has a molecular weight of 125.21 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-1-ethylpyrrolidine is sourced from PubChem (CID 150632984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).