Cyanamide, N-(4-acetamido-4-carbamoylbutyl)-N-nitroso-
Basic information
- CAS
55941-39-4- Standard SMILES
CC(=O)NC(CCCN(C#N)N=O)C(N)=O- InChIKey
GEMGGKYHCZHFGS-UHFFFAOYSA-N- Molecular formula
- C8H13N5O3
- Average molar mass
- 227.22 g/mol
- Monoisotopic mass
- 227.10183929
Names & identifiers
- Preferred name
- Cyanamide, N-(4-acetamido-4-carbamoylbutyl)-N-nitroso-
- IUPAC
- 2-acetamido-5-[cyano(nitroso)amino]pentanamide
Names & synonyms
55941-39-4AcnbcCYANAMIDE, N-(4-ACETAMIDO-4-CARBAMOYLBUTYL)-N-NITROSO-4-Acetamido-4-carboxamido-n(N-nitroso)-butylcyanamideSCHEMBL31297784DTXSID509713575-[Cyano(nitroso)amino]-2-[(1-hydroxyethylidene)amino]pentanimidic acid
Database identifiers
- CAS
55941-39-4- PubChem CID
- 41669
- DTXSID
DTXSID50971357- Nikkaji
- J67.755H
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 321
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Compound notes
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