Basic information
- CAS
2274-01-3- Standard SMILES
CCC(CC)C(=O)NC(N)=O- InChIKey
JIOUJVPLJOQUFD-UHFFFAOYSA-N- Molecular formula
- C7H14N2O2
- Average molar mass
- 158.2 g/mol
- Monoisotopic mass
- 158.10552769
Overview
breakdown product of sodium barbital; structure given in first source
Names & identifiers
- Preferred name
- N-(Aminocarbonyl)-2-ethylbutanamide
- IUPAC
- N-carbamoyl-2-ethylbutanamide
Names & synonyms
Diethylacetylurea2274-01-3Butanamide, N-(aminocarbonyl)-2-ethyl-09BDA5Z11DNSC-27172N-(AMINOCARBONYL)-2-ETHYLBUTANAMIDEDTXSID8020460RefChem:926934DTXCID60460218-885-9N-carbamoyl-2-ethylbutanamide2-Aethylbutyrylharnstoff
Show more names
UREA, 1-(2-ETHYLBUTYRYL)-Ethylbutyrylurea(2-Ethylbutyryl)ureaCCRIS 3076N-Carbamoyl-2-ethylbutyraldehyde2-Aethylbutyrylharnstoff [German]2-EthylbutyrylureaNSC27172
Database identifiers
- CAS
2274-01-3- PubChem CID
- 16768
- DTXSID
DTXSID8020460- UNII
- 09BDA5Z11D
- EC Number
- 218-885-9
- Nikkaji
- J48.926C
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 72.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Experimental & physicochemical properties
LogP0.91
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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