Basic information
- CAS
6053-39-0- Standard SMILES
CCc1ccc(-n2c(C)cc(/C=N/NC(N)=O)c2C)cc1- InChIKey
FCZUKXAOIDZSOW-VCHYOVAHSA-N- Molecular formula
- C16H20N4O
- Average molar mass
- 284.36 g/mol
- Monoisotopic mass
- 284.16371127
Names & identifiers
- Preferred name
- (2E)-2-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinecarboxamide
- IUPAC
- [(E)-[1-(4-ethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]urea
Names & synonyms
(2E)-2-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazinecarboxamide6053-39-0[(E)-[1-(4-ethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]ureaSTK198432DTXSID70417404AKOS000327912BIM-0042899.P001SR-01000226311SR-01000226311-1(2E)-2-{[1-(4-Ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}hydrazine-1-carboxamide
Database identifiers
- CAS
6053-39-0- PubChem CID
- 5347144
- DTXSID
DTXSID70417404
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 72.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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