4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one

C9H15NO2 — CID 58549961

IUPAC4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one
SMILESC=CC1CC(=O)N(CCOC)C1
InChIInChI=1S/C9H15NO2/c1-3-8-6-9(11)10(7-8)4-5-12-2/h3,8H,1,4-7H2,2H3
InChIKeyPMXLFZYOGGNSGH-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.67
Rot. Bonds4

About 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one

4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one (PubChem CID 58549961) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one
PubChem CID58549961
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one
SMILESC=CC1CC(=O)N(CCOC)C1
InChIInChI=1S/C9H15NO2/c1-3-8-6-9(11)10(7-8)4-5-12-2/h3,8H,1,4-7H2,2H3
InChIKeyPMXLFZYOGGNSGH-UHFFFAOYSA-N
XLogP0.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(S)-4-isopropyl-3-(4-pentenoyl)-oxazolidin-2-one
CID 11820460
Vinyl methylpyrrolidone
CID 21695574
2-Methyl-1-morpholin-4-ylpent-4-en-1-one
CID 22628680
3-(2-Methylpent-4-enoyl)-1,3-oxazolidin-2-one
CID 85727474
3-(2-Ethylpent-4-enoyl)-1,3-oxazolidin-2-one
CID 102092257
(4S)-3-[(2R)-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one
CID 134997846
(4S)-4-ethenyl-1-methylpyrrolidin-2-one
CID 166445265
CID 178270075
CID 178270075
(4R)-3-pent-4-enoyl-4-propan-2-yl-1,3-oxazolidin-2-one
CID 10330792
(2R)-2-methyl-1-morpholin-4-ylpent-4-en-1-one
CID 12084219
4-(1-Methylethyl)-3-(2-methyl-1-oxo-4-pentenyl)-2-oxazolidinone
CID 12892386
(4R)-3-[(2S)-2-methylpent-4-enoyl]-4-propan-2-yl-1,3-oxazolidin-2-one
CID 12892387

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one?
The IUPAC name of 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one (CID 58549961) is 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one.
What is the SMILES notation for 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one?
The canonical SMILES for 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one is C=CC1CC(=O)N(CCOC)C1.
What is the InChIKey of 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one?
The InChIKey is PMXLFZYOGGNSGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-3-8-6-9(11)10(7-8)4-5-12-2/h3,8H,1,4-7H2,2H3.
What are the key properties of 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one?
4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one has a molecular weight of 169.22 g/mol, XLogP of 0.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-(2-methoxyethyl)pyrrolidin-2-one is sourced from PubChem (CID 58549961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).