Basic information
- Standard SMILES
COC(=O)c1[nH]c(C(C)(C)C)cc1N- InChIKey
FUFUSKSEUHCLQE-UHFFFAOYSA-N- Molecular formula
- C10H16N2O2
- Average molar mass
- 196.25 g/mol
Names & identifiers
- Preferred name
- methyl 3-amino-5-(tert-butyl)-1H-pyrrole-2-carboxylate
- IUPAC
- methyl 3-amino-5-tert-butyl-1H-pyrrole-2-carboxylate
Names & synonyms
216574-65-1methyl 3-amino-5-(tert-butyl)-1H-pyrrole-2-carboxylatemethyl 3-amino-5-tert-butyl-1H-pyrrole-2-carboxylateSCHEMBL3220088FUFUSKSEUHCLQE-UHFFFAOYSA-Nmethyl 3-amino-5-t-butylpyrrole-2-carboxylatemethyl-3-amino-5-t-butylpyrrole-2-carboxylatemethyl 3-amino-5-tert-butylpyrrole-2-carboxylate
Database identifiers
- PubChem CID
- 18322367
- Nikkaji
- J1.465.229I
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 68.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 223
Related reactions
10 records
Compound notes
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