Basic information
- Standard SMILES
CCN1CCC(c2c[nH]c3ccc(NC(=O)c4ccoc4)nc23)CC1- InChIKey
PMGPBCVPWHOKQP-UHFFFAOYSA-N- Molecular formula
- C19H22N4O2
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.17427596
Names & identifiers
- Preferred name
- 5-(N-[3-furoyl]amino)-3-(ethylpiperidin-4-yl)pyrrolo[3,2-b]pyridine
- IUPAC
- N-[3-(1-ethylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]furan-3-carboxamide
Names & synonyms
SCHEMBL7011819PMGPBCVPWHOKQP-UHFFFAOYSA-N5-(N-[3-furoyl]amino)-3-(1-ethylpiperidin-4-yl)pyrrolo[3,2-b]pyridine5-(N-[3-furoyl]amino)-3-(ethylpiperidin-4-yl)pyrrolo[3,2-b]pyridine
Database identifiers
- PubChem CID
- 19601468
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 466
Related reactions
4 records
Compound notes
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