3-cyclobutyloxy-1-methylimidazolidine-2,4-dione

C8H12N2O3 — CID 130621079

IUPAC3-cyclobutyloxy-1-methylimidazolidine-2,4-dione
SMILESCN1CC(=O)N(OC2CCC2)C1=O
InChIInChI=1S/C8H12N2O3/c1-9-5-7(11)10(8(9)12)13-6-3-2-4-6/h6H,2-5H2,1H3
InChIKeyHDLYYRDKEGMWMV-UHFFFAOYSA-N
MW184.19 g/mol
LogP0.36
Rot. Bonds2

About 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione

3-cyclobutyloxy-1-methylimidazolidine-2,4-dione (PubChem CID 130621079) has the molecular formula C8H12N2O3 and a molecular weight of 184.19 g/mol. Its IUPAC name is 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-cyclobutyloxy-1-methylimidazolidine-2,4-dione
PubChem CID130621079
Molecular FormulaC8H12N2O3
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC Name3-cyclobutyloxy-1-methylimidazolidine-2,4-dione
SMILESCN1CC(=O)N(OC2CCC2)C1=O
InChIInChI=1S/C8H12N2O3/c1-9-5-7(11)10(8(9)12)13-6-3-2-4-6/h6H,2-5H2,1H3
InChIKeyHDLYYRDKEGMWMV-UHFFFAOYSA-N
XLogP0.36
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 50.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione?
The IUPAC name of 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione (CID 130621079) is 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione is CN1CC(=O)N(OC2CCC2)C1=O.
What is the InChIKey of 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione?
The InChIKey is HDLYYRDKEGMWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-9-5-7(11)10(8(9)12)13-6-3-2-4-6/h6H,2-5H2,1H3.
What are the key properties of 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione?
3-cyclobutyloxy-1-methylimidazolidine-2,4-dione has a molecular weight of 184.19 g/mol, XLogP of 0.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyloxy-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 130621079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).