4-[(2-Phenylethyl)amino]-1h-pyrrolo[2,3-b]pyridine-5-carboxamide
Basic information
- CAS
920960-09-4- Standard SMILES
NC(=O)c1cnc2[nH]ccc2c1NCCc1ccccc1- InChIKey
GFNLXPZATIFNFD-UHFFFAOYSA-N- Molecular formula
- C16H16N4O
- Average molar mass
- 280.32 g/mol
- Monoisotopic mass
- 280.13241115
Names & identifiers
- Preferred name
- 4-[(2-Phenylethyl)amino]-1h-pyrrolo[2,3-b]pyridine-5-carboxamide
- IUPAC
- 4-(2-phenylethylamino)-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
Names & synonyms
920960-09-44-[(2-phenylethyl)amino]-1h-pyrrolo[2,3-b]pyridine-5-carboxamideSCHEMBL2103996DTXSID90736740
Database identifiers
- CAS
920960-09-4- PubChem CID
- 67277751
- DTXSID
DTXSID90736740- Nikkaji
- J3.318.877C
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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