1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione

C7H13N3O3 — CID 131176157

IUPAC1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione
SMILESCON(C)CN1CC(=O)N(C)C1=O
InChIInChI=1S/C7H13N3O3/c1-8(13-3)5-10-4-6(11)9(2)7(10)12/h4-5H2,1-3H3
InChIKeyXPVPBWVXTVOPAE-UHFFFAOYSA-N
MW187.20 g/mol
LogP-0.67
Rot. Bonds3

About 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione

1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione (PubChem CID 131176157) has the molecular formula C7H13N3O3 and a molecular weight of 187.20 g/mol. Its IUPAC name is 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione
PubChem CID131176157
Molecular FormulaC7H13N3O3
Molecular Weight187.20 g/mol
Exact Mass187.10
IUPAC Name1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione
SMILESCON(C)CN1CC(=O)N(C)C1=O
InChIInChI=1S/C7H13N3O3/c1-8(13-3)5-10-4-6(11)9(2)7(10)12/h4-5H2,1-3H3
InChIKeyXPVPBWVXTVOPAE-UHFFFAOYSA-N
XLogP-0.67
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 5-0.67
H-Bond Donors ≤ 50
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 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione?
The IUPAC name of 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione (CID 131176157) is 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione.
What is the SMILES notation for 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione?
The canonical SMILES for 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione is CON(C)CN1CC(=O)N(C)C1=O.
What is the InChIKey of 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione?
The InChIKey is XPVPBWVXTVOPAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O3/c1-8(13-3)5-10-4-6(11)9(2)7(10)12/h4-5H2,1-3H3.
What are the key properties of 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione?
1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione has a molecular weight of 187.20 g/mol, XLogP of -0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methoxy(methyl)amino]methyl]-3-methylimidazolidine-2,4-dione is sourced from PubChem (CID 131176157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).