N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide

C10H17N3O3 — CID 10977207

IUPACN-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide
SMILESCCNC(=O)C1(C)C(=O)NC(=O)N1C(C)C
InChIInChI=1S/C10H17N3O3/c1-5-11-7(14)10(4)8(15)12-9(16)13(10)6(2)3/h6H,5H2,1-4H3,(H,11,14)(H,12,15,16)
InChIKeyLMPLZLFBXIQBOF-UHFFFAOYSA-N
MW227.26 g/mol
LogP-0.16
Rot. Bonds3

About N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide

N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide (PubChem CID 10977207) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide
PubChem CID10977207
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC NameN-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide
SMILESCCNC(=O)C1(C)C(=O)NC(=O)N1C(C)C
InChIInChI=1S/C10H17N3O3/c1-5-11-7(14)10(4)8(15)12-9(16)13(10)6(2)3/h6H,5H2,1-4H3,(H,11,14)(H,12,15,16)
InChIKeyLMPLZLFBXIQBOF-UHFFFAOYSA-N
XLogP-0.16
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

3,5-Dimethyl-2,4-Imidazolidinedione
CID 10154061
5,5-Dimethyl-3-(piperazin-1-ylmethyl)imidazolidine-2,4-dione
CID 6501454
3-Ethyl-5,5-dimethylimidazolidine-2,4-dione
CID 588189
3-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)propanenitrile
CID 597160
3-(2-(Diethylamino)ethyl)-5,5-dimethylhydantoin
CID 3028666
5,5-Dimethyl-3-(2-piperazin-1-ylethyl)imidazolidine-2,4-dione
CID 43162333
5,5-Dimethyl-3-(2-pyrrolidin-1-ylethyl)imidazolidine-2,4-dione
CID 47013852
5,5-Dimethyl-3-[2-(4-methylpiperazin-1-yl)ethyl]imidazolidine-2,4-dione
CID 137649325
3-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)propyl-trimethylazanium chloride
CID 155562366
2-tert-Butyl-3,5-dimethyl-4-imidazolidinone, (2R,5S)-
CID 44190959
3-Butyl-5-methylimidazolidine-2,4-dione
CID 335477
Imidazolidine-2,4-dione, 1-acetyl-5-methyl-
CID 85822576

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide?
The IUPAC name of N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide (CID 10977207) is N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide.
What is the SMILES notation for N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide?
The canonical SMILES for N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide is CCNC(=O)C1(C)C(=O)NC(=O)N1C(C)C.
What is the InChIKey of N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide?
The InChIKey is LMPLZLFBXIQBOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c1-5-11-7(14)10(4)8(15)12-9(16)13(10)6(2)3/h6H,5H2,1-4H3,(H,11,14)(H,12,15,16).
What are the key properties of N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide?
N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide has a molecular weight of 227.26 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2,5-dioxo-3-propan-2-ylimidazolidine-4-carboxamide is sourced from PubChem (CID 10977207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).