3,5-Bis(pyridin-4-ylmethyl)pyridine-2,6-diamine
Basic information
- CAS
76274-22-1- Standard SMILES
Nc1nc(N)c(Cc2ccncc2)cc1Cc1ccncc1- InChIKey
SGJBIUYRJJNSMD-UHFFFAOYSA-N- Molecular formula
- C17H17N5
- Average molar mass
- 291.35 g/mol
- Monoisotopic mass
- 291.14839556
Names & identifiers
- Preferred name
- 3,5-Bis(pyridin-4-ylmethyl)pyridine-2,6-diamine
- IUPAC
- 3,5-bis(pyridin-4-ylmethyl)pyridine-2,6-diamine
Names & synonyms
76274-22-13,5-bis(pyridin-4-ylmethyl)pyridine-2,6-diamineNSC350990DTXSID80319809NSC-350990AF-684/303280033,5-Bis[(pyridin-4-yl)methyl]pyridine-2,6-diamine
Database identifiers
- CAS
76274-22-1- PubChem CID
- 336446
- DTXSID
DTXSID80319809
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 295
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Compound notes
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