Basic information
- Standard SMILES
CCCC(C)(C)NC(=O)NC1=CC(=O)OC1- InChIKey
ZELJTCPVGHKLBK-UHFFFAOYSA-N- Molecular formula
- C11H18N2O3
- Average molar mass
- 226.27 g/mol
Names & identifiers
- Preferred name
- 1-(1,1-Dimethylbutyl)-3-(2,5-dihydro-5-oxo-3-furyl)urea
- IUPAC
- 1-(2-methylpentan-2-yl)-3-(5-oxo-2H-furan-3-yl)urea
Names & synonyms
SCHEMBL11730921ZELJTCPVGHKLBK-UHFFFAOYSA-N1-(1,1-dimethylbutyl)-3-(2,5-dihydro-5-oxo-3-furyl)urea
Database identifiers
- PubChem CID
- 21487890
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 321
Related reactions
2 records
Compound notes
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