Basic information
- CAS
40556-25-0- Standard SMILES
C=CCC(CC=C)(C(=O)O)C(=O)NC(=O)NC1CCCCC1- InChIKey
IVLANWURJTXCSR-UHFFFAOYSA-N- Molecular formula
- C16H24N2O4
- Average molar mass
- 308.37 g/mol
- Monoisotopic mass
- 308.17360725
Names & identifiers
- Preferred name
- Malonamic acid, N-(cyclohexylcarbamoyl)-2,2-diallyl-
- IUPAC
- 2-(cyclohexylcarbamoylcarbamoyl)-2-prop-2-enylpent-4-enoic acid
Names & synonyms
Cyclohexylureide-diallylmalonamic acid40556-25-0BRN 06804444-Pentenoic acid, 2-((((cyclohexylamino)carbonyl)amino)carbonyl)-2-(2-propenyl)-N-(4-Cyclohexylcarbamoyl)-2,2-diallylmalonamic acidMALONAMIC ACID, N-(CYCLOHEXYLCARBAMOYL)-2,2-DIALLYL-RefChem:351823DTXSID109609692-Allyl-2-((cyclohexylcarbamoyl)carbamoyl)pent-4-enoic acid2-[{[(Cyclohexylimino)(hydroxy)methyl]imino}(hydroxy)methyl]-2-(prop-2-en-1-yl)pent-4-enoic acid
Database identifiers
- CAS
40556-25-0- PubChem CID
- 38519
- DTXSID
DTXSID10960969
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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