3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide

C9H15N3O3 — CID 60656567

IUPAC3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide
SMILESCNC(=O)CCN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C9H15N3O3/c1-9(2)7(14)12(8(15)11-9)5-4-6(13)10-3/h4-5H2,1-3H3,(H,10,13)(H,11,15)
InChIKeyRDXSKHAZGQEJMO-UHFFFAOYSA-N
MW213.24 g/mol
LogP-0.55
Rot. Bonds3

About 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide

3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide (PubChem CID 60656567) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide.

Molecular Properties

Compound Name3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide
PubChem CID60656567
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC Name3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide
SMILESCNC(=O)CCN1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C9H15N3O3/c1-9(2)7(14)12(8(15)11-9)5-4-6(13)10-3/h4-5H2,1-3H3,(H,10,13)(H,11,15)
InChIKeyRDXSKHAZGQEJMO-UHFFFAOYSA-N
XLogP-0.55
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-[3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanoylamino]propanoic acid
CID 93263187
propan-2-yl 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)propanoate
CID 112722968
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[1-(hydroxymethyl)cyclopentyl]propanamide
CID 62517031
3-(5-chloro-3-oxopentyl)-5,5-dimethylimidazolidine-2,4-dione
CID 21493759
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-hydroxy-2,2-dimethylbutyl)propanamide
CID 103825428
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-pyrrol-3-ylmethyl)propanamide
CID 106385438
5-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)pentanoic acid
CID 28971868
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-hydroxycyclohexyl)propanamide
CID 62367006
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1H-imidazol-2-yl)propanamide
CID 63563497
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1R)-1-phenylethyl]propanamide
CID 40795155
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(3-methylcyclopentyl)propanamide
CID 114549974
3-[2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethylamino]propanoic acid
CID 43466330

Frequently Asked Questions

What is the IUPAC name of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide?
The IUPAC name of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide (CID 60656567) is 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide.
What is the SMILES notation for 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide?
The canonical SMILES for 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide is CNC(=O)CCN1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide?
The InChIKey is RDXSKHAZGQEJMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c1-9(2)7(14)12(8(15)11-9)5-4-6(13)10-3/h4-5H2,1-3H3,(H,10,13)(H,11,15).
What are the key properties of 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide?
3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide has a molecular weight of 213.24 g/mol, XLogP of -0.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-methylpropanamide is sourced from PubChem (CID 60656567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).