2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide

C12H18N2O2 — CID 108516735

IUPAC2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide
SMILESC=CCN(CC=C)C(=O)C(=O)N1CCCC1
InChIInChI=1S/C12H18N2O2/c1-3-7-13(8-4-2)11(15)12(16)14-9-5-6-10-14/h3-4H,1-2,5-10H2
InChIKeyRHQUXOFHFMZFCQ-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.81
Rot. Bonds4

About 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide

2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide (PubChem CID 108516735) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound Name2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide
PubChem CID108516735
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide
SMILESC=CCN(CC=C)C(=O)C(=O)N1CCCC1
InChIInChI=1S/C12H18N2O2/c1-3-7-13(8-4-2)11(15)12(16)14-9-5-6-10-14/h3-4H,1-2,5-10H2
InChIKeyRHQUXOFHFMZFCQ-UHFFFAOYSA-N
XLogP0.81
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-prop-2-enyl-N-propylpiperidine-1-carboxamide
CID 116657075
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-N-prop-2-enylacetamide
CID 113115517
N-ethyl-N-(2-hydroxyethyl)-2-oxo-2-piperidin-1-ylacetamide
CID 108517236
N,N-bis(prop-2-enyl)piperazine-1-carboxamide
CID 70546144
1-(2-hydroxyethyl)-3-(2-oxo-2-pyrrolidin-1-ylethyl)-1-prop-2-enylurea
CID 86964529
1-(2,2-dimethylpropanoyl)-N,N-bis(prop-2-enyl)piperidine-3-carboxamide
CID 47998464
tert-butyl N-(3-oxo-3-pyrrolidin-1-ylpropyl)-N-prop-2-enylcarbamate
CID 118798912
4-methyl-1-pyrrolidin-1-ylpent-3-ene-1,2-dione
CID 150340291
N,N-bis(2-amino-2-oxoethyl)-2-(1,4-diazepan-1-yl)-2-oxoacetamide
CID 62922120
2-[piperidin-1-ylcarbamoyl(prop-2-enyl)amino]acetic acid
CID 83019737
prop-2-enyl 2-[bis(prop-2-enyl)amino]-2-oxoacetate
CID 139567559
4-[bis(prop-2-enyl)amino]-3,4-dioxobutanoic acid
CID 20633701

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide?
The IUPAC name of 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide (CID 108516735) is 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide is C=CCN(CC=C)C(=O)C(=O)N1CCCC1.
What is the InChIKey of 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide?
The InChIKey is RHQUXOFHFMZFCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-7-13(8-4-2)11(15)12(16)14-9-5-6-10-14/h3-4H,1-2,5-10H2.
What are the key properties of 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide?
2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide has a molecular weight of 222.29 g/mol, XLogP of 0.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N,N-bis(prop-2-enyl)-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 108516735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).