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

C8H13NO2 — CID 168685259

IUPAC4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one
SMILESC=CC1CC(=O)N(CCO)C1
InChIInChI=1S/C8H13NO2/c1-2-7-5-8(11)9(6-7)3-4-10/h2,7,10H,1,3-6H2
InChIKeyDTXVFHVWGGDYEE-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.01
Rot. Bonds3

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

4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one (PubChem CID 168685259) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one
PubChem CID168685259
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one
SMILESC=CC1CC(=O)N(CCO)C1
InChIInChI=1S/C8H13NO2/c1-2-7-5-8(11)9(6-7)3-4-10/h2,7,10H,1,3-6H2
InChIKeyDTXVFHVWGGDYEE-UHFFFAOYSA-N
XLogP0.01
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-ethenyl-1-(6-hydroxyhexyl)pyrrolidin-2-one
CID 168685210
4-ethenyl-1-(3-trihydroxysilylpropyl)pyrrolidin-2-one
CID 168685234
4-ethenyl-1-hexylpyrrolidin-2-one
CID 168684076
1-[3-(azepan-1-yl)propyl]-4-ethenylpyrrolidin-2-one
CID 168685223
4-ethenyl-1-[4-(4-methylpiperazin-1-yl)butyl]pyrrolidin-2-one
CID 168684281
4-ethenyl-1-[2-(oxan-4-yl)ethyl]pyrrolidin-2-one
CID 168685200
4-ethenyl-1-(3-morpholin-4-ylpropyl)pyrrolidin-2-one
CID 168685224
1-(2-hydroxyethyl)-4-methylpyrrolidin-2-one
CID 63100627
1-(2-hydroxyethyl)-4-sulfanylpyrrolidin-2-one
CID 168709345
(4R)-1-(2-hydroxyethyl)-4-methylpyrrolidin-2-one
CID 170372384
(3S)-1-(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxylate
CID 7045753
4-ethenyl-1-[(1-hydroxycyclohexyl)methyl]pyrrolidin-2-one
CID 168685188

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one?
The IUPAC name of 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one (CID 168685259) is 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one.
What is the SMILES notation for 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one?
The canonical SMILES for 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one is C=CC1CC(=O)N(CCO)C1.
What is the InChIKey of 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one?
The InChIKey is DTXVFHVWGGDYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-2-7-5-8(11)9(6-7)3-4-10/h2,7,10H,1,3-6H2.
What are the key properties of 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one?
4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one has a molecular weight of 155.20 g/mol, XLogP of 0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-(2-hydroxyethyl)pyrrolidin-2-one is sourced from PubChem (CID 168685259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).