acetamide;imidazolidine-2,4-dione

C5H9N3O3 — CID 159110028

IUPACacetamide;imidazolidine-2,4-dione
SMILESCC(N)=O.O=C1CNC(=O)N1
InChIInChI=1S/C3H4N2O2.C2H5NO/c6-2-1-4-3(7)5-2;1-2(3)4/h1H2,(H2,4,5,6,7);1H3,(H2,3,4)
InChIKeyKEJJAOIXRGLBGD-UHFFFAOYSA-N
MW159.15 g/mol
LogP-1.68
Rot. Bonds

About acetamide;imidazolidine-2,4-dione

acetamide;imidazolidine-2,4-dione (PubChem CID 159110028) has the molecular formula C5H9N3O3 and a molecular weight of 159.15 g/mol. Its IUPAC name is acetamide;imidazolidine-2,4-dione.

Molecular Properties

Compound Nameacetamide;imidazolidine-2,4-dione
PubChem CID159110028
Molecular FormulaC5H9N3O3
Molecular Weight159.15 g/mol
Exact Mass159.06
IUPAC Nameacetamide;imidazolidine-2,4-dione
SMILESCC(N)=O.O=C1CNC(=O)N1
InChIInChI=1S/C3H4N2O2.C2H5NO/c6-2-1-4-3(7)5-2;1-2(3)4/h1H2,(H2,4,5,6,7);1H3,(H2,3,4)
InChIKeyKEJJAOIXRGLBGD-UHFFFAOYSA-N
XLogP-1.68
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.15
LogP ≤ 5-1.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethane;imidazolidine-2,4-dione
CID 90911393
copper;imidazolidine-2,4-dione
CID 67120841
imidazolidine-2,4-dione;trihydrate
CID 70617866
ethyl propanoate;imidazolidine-2,4-dione
CID 174888104
(2S)-2-amino-3-methyl-3-sulfanylbutanoic acid;imidazolidine-2,4-dione
CID 91622674
CID 67541617
CID 67541617
dodecanoic acid;imidazolidine-2,4-dione
CID 174508085
1,3-dimethylimidazolidine-2,4-dione;imidazolidine-2,4-dione
CID 71073934
imidazolidine-2,4-dione;pyrazolidin-3-one
CID 67936630
1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone
CID 71356739
butyl 1-iodopropyl carbonate;imidazolidine-2,4-dione
CID 68980973
aziridin-2-one
CID 158991665

Frequently Asked Questions

What is the IUPAC name of acetamide;imidazolidine-2,4-dione?
The IUPAC name of acetamide;imidazolidine-2,4-dione (CID 159110028) is acetamide;imidazolidine-2,4-dione.
What is the SMILES notation for acetamide;imidazolidine-2,4-dione?
The canonical SMILES for acetamide;imidazolidine-2,4-dione is CC(N)=O.O=C1CNC(=O)N1.
What is the InChIKey of acetamide;imidazolidine-2,4-dione?
The InChIKey is KEJJAOIXRGLBGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2O2.C2H5NO/c6-2-1-4-3(7)5-2;1-2(3)4/h1H2,(H2,4,5,6,7);1H3,(H2,3,4).
What are the key properties of acetamide;imidazolidine-2,4-dione?
acetamide;imidazolidine-2,4-dione has a molecular weight of 159.15 g/mol, XLogP of -1.68, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetamide;imidazolidine-2,4-dione is sourced from PubChem (CID 159110028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).