1-(1-aminoethenyl)pyrrolidin-2-one

C6H10N2O — CID 18740015

IUPAC1-(1-aminoethenyl)pyrrolidin-2-one
SMILESC=C(N)N1CCCC1=O
InChIInChI=1S/C6H10N2O/c1-5(7)8-4-2-3-6(8)9/h1-4,7H2
InChIKeyBKZPOWIWDXLHCA-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.04
Rot. Bonds1

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

1-(1-aminoethenyl)pyrrolidin-2-one (PubChem CID 18740015) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 1-(1-aminoethenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(1-aminoethenyl)pyrrolidin-2-one
PubChem CID18740015
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name1-(1-aminoethenyl)pyrrolidin-2-one
SMILESC=C(N)N1CCCC1=O
InChIInChI=1S/C6H10N2O/c1-5(7)8-4-2-3-6(8)9/h1-4,7H2
InChIKeyBKZPOWIWDXLHCA-UHFFFAOYSA-N
XLogP0.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-aminoethenyl)pyrrolidin-2-one?
The IUPAC name of 1-(1-aminoethenyl)pyrrolidin-2-one (CID 18740015) is 1-(1-aminoethenyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(1-aminoethenyl)pyrrolidin-2-one?
The canonical SMILES for 1-(1-aminoethenyl)pyrrolidin-2-one is C=C(N)N1CCCC1=O.
What is the InChIKey of 1-(1-aminoethenyl)pyrrolidin-2-one?
The InChIKey is BKZPOWIWDXLHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-5(7)8-4-2-3-6(8)9/h1-4,7H2.
What are the key properties of 1-(1-aminoethenyl)pyrrolidin-2-one?
1-(1-aminoethenyl)pyrrolidin-2-one has a molecular weight of 126.16 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminoethenyl)pyrrolidin-2-one is sourced from PubChem (CID 18740015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).