1H-Pyrazole-1-carboxamide, N,N'-1,6-hexanediylbis(3(or 5)-methyl-
Basic information
- CAS
147160-51-8- Standard SMILES
Cc1ccn(C(=O)NCCCCCCNC(=O)n2ccc(C)n2)n1- InChIKey
XSBHTRGQLMDQHV-UHFFFAOYSA-N- Molecular formula
- C16H24N6O2
- Average molar mass
- 332.4 g/mol
- Monoisotopic mass
- 332.19607403
Names & identifiers
- Preferred name
- 1H-Pyrazole-1-carboxamide, N,N'-1,6-hexanediylbis(3(or 5)-methyl-
- IUPAC
- 3-methyl-N-[6-[(3-methylpyrazole-1-carbonyl)amino]hexyl]pyrazole-1-carboxamide
Names & synonyms
1H-Pyrazole-1-carboxamide, N,N'-1,6-hexanediylbis(3(or 5)-methyl-147160-51-8DTXSID60163600N,N'-1,6-Hexanediylbis(3(or 5)-methyl-1H-pyrazole-1-carboxamide)RefChem:239872DTXCID1086091SCHEMBL30171330N,N'-(Hexane-1,6-diyl)bis(3-methyl-1H-pyrazole-1-carboxamide)
Database identifiers
- CAS
147160-51-8- PubChem CID
- 3073191
- DTXSID
DTXSID60163600
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 93.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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