1-prop-2-enoylimidazolidin-2-one

C6H8N2O2 — CID 14273533

IUPAC1-prop-2-enoylimidazolidin-2-one
SMILESC=CC(=O)N1CCNC1=O
InChIInChI=1S/C6H8N2O2/c1-2-5(9)8-4-3-7-6(8)10/h2H,1,3-4H2,(H,7,10)
InChIKeyNOGWCEWHRRVCQY-UHFFFAOYSA-N
MW140.14 g/mol
LogP-0.28
Rot. Bonds1

About 1-prop-2-enoylimidazolidin-2-one

1-prop-2-enoylimidazolidin-2-one (PubChem CID 14273533) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 1-prop-2-enoylimidazolidin-2-one.

Molecular Properties

Compound Name1-prop-2-enoylimidazolidin-2-one
PubChem CID14273533
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name1-prop-2-enoylimidazolidin-2-one
SMILESC=CC(=O)N1CCNC1=O
InChIInChI=1S/C6H8N2O2/c1-2-5(9)8-4-3-7-6(8)10/h2H,1,3-4H2,(H,7,10)
InChIKeyNOGWCEWHRRVCQY-UHFFFAOYSA-N
XLogP-0.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

1-(Prop-2-en-1-yl)imidazolidine-2,4-dione
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3-((2-Pyrrolidine-1-yl)-ethyl)uracil
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1-(Prop-2-en-1-yl)imidazolidine-2,4,5-trione
CID 2110938
1-((2-Pyrrolidin-1-yl)ethyl)uracil
CID 49845374
2-Propenamide, N,N'-[(2-oxo-1,3-imidazolidinediyl)bis(methylene)]bis-
CID 88051
3-(Prop-2-en-1-yl)imidazolidine-2,4-dione
CID 330948
N-[2-(2-Oxo-1-imidazolidinyl)ethyl]-2-butenamide
CID 114663
N-(2-(2-Oxoimidazolidin-1-yl)ethyl)acrylamide
CID 76532
N-((2-Oxoimidazolidin-1-yl)methyl)acrylamide
CID 3021104
N-allyl-5-oxo-2H-pyrrole-1-carboxamide
CID 134815541
N-(((1-Oxo-3-((2-(2-oxoimidazolidin-1-yl)ethyl)amino)propyl)amino)methyl)acrylamide
CID 3024600
N-(2-(2-Oxoimidazolidin-1-yl)ethyl)crotonamide
CID 6437825

Frequently Asked Questions

What is the IUPAC name of 1-prop-2-enoylimidazolidin-2-one?
The IUPAC name of 1-prop-2-enoylimidazolidin-2-one (CID 14273533) is 1-prop-2-enoylimidazolidin-2-one.
What is the SMILES notation for 1-prop-2-enoylimidazolidin-2-one?
The canonical SMILES for 1-prop-2-enoylimidazolidin-2-one is C=CC(=O)N1CCNC1=O.
What is the InChIKey of 1-prop-2-enoylimidazolidin-2-one?
The InChIKey is NOGWCEWHRRVCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c1-2-5(9)8-4-3-7-6(8)10/h2H,1,3-4H2,(H,7,10).
What are the key properties of 1-prop-2-enoylimidazolidin-2-one?
1-prop-2-enoylimidazolidin-2-one has a molecular weight of 140.14 g/mol, XLogP of -0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enoylimidazolidin-2-one is sourced from PubChem (CID 14273533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).