Basic information
- Standard SMILES
CC(N)c1nc2ccn(C)c2cc1N1CC(O)C1- InChIKey
NPEBDGACSIDCER-UHFFFAOYSA-N- Molecular formula
- C13H18N4O
- Average molar mass
- 246.31 g/mol
Names & identifiers
- Preferred name
- 1-(5-(1-Aminoethyl)-1-methyl-1H-pyrrolo[3,2-b]pyridin-6-yl)azetidin-3-ol
- IUPAC
- 1-[5-(1-aminoethyl)-1-methylpyrrolo[3,2-b]pyridin-6-yl]azetidin-3-ol
Names & synonyms
SCHEMBL15411665NPEBDGACSIDCER-UHFFFAOYSA-N1-(5-(1-Aminoethyl)-1-methyl-1H-pyrrolo[3,2-b]pyridin-6-yl)azetidin-3-ol
Database identifiers
- PubChem CID
- 86708010
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 307
Related reactions
3 records
Compound notes
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