Basic information
- Standard SMILES
Nc1cnccc1CCOc1ccc(N)c2ccccc12- InChIKey
KNESKGAEOSZHEL-UHFFFAOYSA-N- Molecular formula
- C17H17N3O
- Average molar mass
- 279.34 g/mol
- Monoisotopic mass
- 279.13716217
Names & identifiers
- Preferred name
- 4-(2-(4-Aminonaphthalen-1-yloxy)ethyl)pyridin-3-amine
- IUPAC
- 4-[2-(4-aminonaphthalen-1-yl)oxyethyl]pyridin-3-amine
Names & synonyms
SCHEMBL1978977KNESKGAEOSZHEL-UHFFFAOYSA-NDB-4121024-(2-(4-Aminonaphthalen-1-yloxy)ethyl)pyridin-3-amine4-[2-[(4-Amino-1-naphthalenyl)oxy]ethyl]-3-pyridinamine1220627-21-3
Database identifiers
- PubChem CID
- 58416779
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 325
Related reactions
10 records
Compound notes
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