2-Piperazinecarboxanilide, 2'-methyl-, dihydrochloride
Basic information
- CAS
36385-58-7- Standard SMILES
Cc1ccccc1NC(=O)N1CCNCC1.Cl.Cl- InChIKey
ONPILPIMMVIVAE-UHFFFAOYSA-N- Molecular formula
- C12H19Cl2N3O
- Average molar mass
- 292.2 g/mol
- Monoisotopic mass
- 291.0905176
Names & identifiers
- Preferred name
- 2-Piperazinecarboxanilide, 2'-methyl-, dihydrochloride
- IUPAC
- N-(2-methylphenyl)piperazine-1-carboxamide;dihydrochloride
Names & synonyms
2-Piperazinecarboxanilide, 2'-methyl-, dihydrochloride36385-58-72-Piperazinecarboxamide, N-(2-methylphenyl)-, dihydrochlorideDTXSID70189912RefChem:265436DTXCID30112403N-(2-Methylphenyl)piperazine-1-carboxamide--hydrogen chloride (1/2)
Database identifiers
- CAS
36385-58-7- PubChem CID
- 118965
- DTXSID
DTXSID70189912
Properties
Computed structural properties
- Topological polar surface area
- 44.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 238
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Compound notes
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