1-(2-ethenoxyethenyl)pyrrolidin-2-one

C8H11NO2 — CID 66766337

IUPAC1-(2-ethenoxyethenyl)pyrrolidin-2-one
SMILESC=COC=CN1CCCC1=O
InChIInChI=1S/C8H11NO2/c1-2-11-7-6-9-5-3-4-8(9)10/h2,6-7H,1,3-5H2
InChIKeyJHUYUIQCWBZKTB-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.24
Rot. Bonds3

About 1-(2-ethenoxyethenyl)pyrrolidin-2-one

1-(2-ethenoxyethenyl)pyrrolidin-2-one (PubChem CID 66766337) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 1-(2-ethenoxyethenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-ethenoxyethenyl)pyrrolidin-2-one
PubChem CID66766337
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name1-(2-ethenoxyethenyl)pyrrolidin-2-one
SMILESC=COC=CN1CCCC1=O
InChIInChI=1S/C8H11NO2/c1-2-11-7-6-9-5-3-4-8(9)10/h2,6-7H,1,3-5H2
InChIKeyJHUYUIQCWBZKTB-UHFFFAOYSA-N
XLogP1.24
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.24
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 1-(2-ethenoxyethenyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-ethenoxyethenyl)pyrrolidin-2-one (CID 66766337) is 1-(2-ethenoxyethenyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-ethenoxyethenyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-ethenoxyethenyl)pyrrolidin-2-one is C=COC=CN1CCCC1=O.
What is the InChIKey of 1-(2-ethenoxyethenyl)pyrrolidin-2-one?
The InChIKey is JHUYUIQCWBZKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-2-11-7-6-9-5-3-4-8(9)10/h2,6-7H,1,3-5H2.
What are the key properties of 1-(2-ethenoxyethenyl)pyrrolidin-2-one?
1-(2-ethenoxyethenyl)pyrrolidin-2-one has a molecular weight of 153.18 g/mol, XLogP of 1.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethenoxyethenyl)pyrrolidin-2-one is sourced from PubChem (CID 66766337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).