ethyl 4-(2-aminoethyl)-1H-pyrrole-2-carboxylate
Basic information
- Standard SMILES
CCOC(=O)c1cc(CCN)c[nH]1- InChIKey
QYEPHENBAPZRTM-UHFFFAOYSA-N- Molecular formula
- C9H14N2O2
- Average molar mass
- 182.22 g/mol
Names & identifiers
- Preferred name
- ethyl 4-(2-aminoethyl)-1H-pyrrole-2-carboxylate
- IUPAC
- ethyl 4-(2-aminoethyl)-1H-pyrrole-2-carboxylate
Names & synonyms
ethyl 4-(2-aminoethyl)-1H-pyrrole-2-carboxylate1265965-09-0SCHEMBL260789QYEPHENBAPZRTM-UHFFFAOYSA-Nethyl4-(2-aminoethyl)-1H-pyrrole-2-carboxylate
Database identifiers
- PubChem CID
- 66636613
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 68.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 173
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Related reactions
7 records
Compound notes
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