Basic information
- Standard SMILES
CC(C)(C)c1cc(N)c(C(=O)N2CCNC(=O)C2(C)C)[nH]1- InChIKey
NYPCSHQAGWDCFP-UHFFFAOYSA-N- Molecular formula
- C15H24N4O2
- Average molar mass
- 292.38 g/mol
Names & identifiers
- Preferred name
- 4-(4-amino-2-tert-butyl-1H-pyrrole-5-carbonyl)-3,3-dimethylpiperazin-2-one
- IUPAC
- 4-(3-amino-5-tert-butyl-1H-pyrrole-2-carbonyl)-3,3-dimethylpiperazin-2-one
Names & synonyms
SCHEMBL3545622NYPCSHQAGWDCFP-UHFFFAOYSA-N4-(4-amino-2-tert-butyl-1H-pyrrole-5-carbonyl)-3,3-dimethylpiperazin-2-one
Database identifiers
- PubChem CID
- 58679259
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 91.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 441
Related reactions
2 records
Compound notes
Loading…