5,5-bis(ethenyl)pyrrolidin-2-one

C8H11NO — CID 118696195

IUPAC5,5-bis(ethenyl)pyrrolidin-2-one
SMILESC=CC1(C=C)CCC(=O)N1
InChIInChI=1S/C8H11NO/c1-3-8(4-2)6-5-7(10)9-8/h3-4H,1-2,5-6H2,(H,9,10)
InChIKeyVMGPYPFGOZCVCV-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.01
Rot. Bonds2

About 5,5-bis(ethenyl)pyrrolidin-2-one

5,5-bis(ethenyl)pyrrolidin-2-one (PubChem CID 118696195) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 5,5-bis(ethenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name5,5-bis(ethenyl)pyrrolidin-2-one
PubChem CID118696195
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name5,5-bis(ethenyl)pyrrolidin-2-one
SMILESC=CC1(C=C)CCC(=O)N1
InChIInChI=1S/C8H11NO/c1-3-8(4-2)6-5-7(10)9-8/h3-4H,1-2,5-6H2,(H,9,10)
InChIKeyVMGPYPFGOZCVCV-UHFFFAOYSA-N
XLogP1.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,5-bis(ethenyl)pyrrolidin-2-one?
The IUPAC name of 5,5-bis(ethenyl)pyrrolidin-2-one (CID 118696195) is 5,5-bis(ethenyl)pyrrolidin-2-one.
What is the SMILES notation for 5,5-bis(ethenyl)pyrrolidin-2-one?
The canonical SMILES for 5,5-bis(ethenyl)pyrrolidin-2-one is C=CC1(C=C)CCC(=O)N1.
What is the InChIKey of 5,5-bis(ethenyl)pyrrolidin-2-one?
The InChIKey is VMGPYPFGOZCVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-3-8(4-2)6-5-7(10)9-8/h3-4H,1-2,5-6H2,(H,9,10).
What are the key properties of 5,5-bis(ethenyl)pyrrolidin-2-one?
5,5-bis(ethenyl)pyrrolidin-2-one has a molecular weight of 137.18 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis(ethenyl)pyrrolidin-2-one is sourced from PubChem (CID 118696195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).