Basic information
- CAS
93369-30-3- Standard SMILES
C(=N[C@H]1CCCC[C@H]1N=Cc1ccc[nH]1)c1ccc[nH]1- InChIKey
WTLWSXYTKRRXRH-IYBDPMFKSA-N- Molecular formula
- C16H20N4
- Average molar mass
- 268.36 g/mol
- Monoisotopic mass
- 268.16879665
Names & identifiers
- Preferred name
- 1-(1H-pyrrol-2-yl)-N-[(1R,2S)-2-(1H-pyrrol-2-ylmethylideneamino)cyclohexyl]methanimine
- IUPAC
- 1-(1H-pyrrol-2-yl)-N-[(1R,2S)-2-(1H-pyrrol-2-ylmethylideneamino)cyclohexyl]methanimine
Names & synonyms
NSC35135593369-30-3DTXSID30419560NSC-351355(1R,2S)-N~1~,N~2~-Bis[(E)-(2H-pyrrol-2-ylidene)methyl]cyclohexane-1,2-diamine
Database identifiers
- CAS
93369-30-3- PubChem CID
- 336579
- DTXSID
DTXSID30419560
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 318
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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