methyl 3-amino-5-(tert-butyl)-1H-pyrrole-2-carboxylate

HCID 18322367

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

Related reactions

10 records

Compound notes

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