N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide

C9H15N3O4 — CID 60701124

IUPACN-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
SMILESCONC(=O)CCCN1C(=O)CN(C)C1=O
InChIInChI=1S/C9H15N3O4/c1-11-6-8(14)12(9(11)15)5-3-4-7(13)10-16-2/h3-6H2,1-2H3,(H,10,13)
InChIKeyHMFQUYQGENZMTE-UHFFFAOYSA-N
MW229.24 g/mol
LogP-0.66
Rot. Bonds5

About N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide

N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide (PubChem CID 60701124) has the molecular formula C9H15N3O4 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide.

Molecular Properties

Compound NameN-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
PubChem CID60701124
Molecular FormulaC9H15N3O4
Molecular Weight229.24 g/mol
Exact Mass229.11
IUPAC NameN-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
SMILESCONC(=O)CCCN1C(=O)CN(C)C1=O
InChIInChI=1S/C9H15N3O4/c1-11-6-8(14)12(9(11)15)5-3-4-7(13)10-16-2/h3-6H2,1-2H3,(H,10,13)
InChIKeyHMFQUYQGENZMTE-UHFFFAOYSA-N
XLogP-0.66
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 5-0.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide?
The IUPAC name of N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide (CID 60701124) is N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide.
What is the SMILES notation for N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide?
The canonical SMILES for N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide is CONC(=O)CCCN1C(=O)CN(C)C1=O.
What is the InChIKey of N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide?
The InChIKey is HMFQUYQGENZMTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O4/c1-11-6-8(14)12(9(11)15)5-3-4-7(13)10-16-2/h3-6H2,1-2H3,(H,10,13).
What are the key properties of N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide?
N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide has a molecular weight of 229.24 g/mol, XLogP of -0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide is sourced from PubChem (CID 60701124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).