Basic information
- Standard SMILES
Nc1ccccc1NCC1CCN(c2ccncc2)CC1- InChIKey
GVHJLVZLFSSQKK-UHFFFAOYSA-N- Molecular formula
- C17H22N4
- Average molar mass
- 282.4 g/mol
- Monoisotopic mass
- 282.18444672
Names & identifiers
- Preferred name
- N1-[1-(4-pyridyl)piperidin-4-ylmethyl)-1,2-benzenediamine
- IUPAC
- 2-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]benzene-1,2-diamine
Names & synonyms
N1-[1-(4-pyridyl)piperidin-4-ylmethyl)-1,2-benzenediaminen1-[1-(4-pyridyl)piperidin-4-ylmethyl]-1,2-benzenediamineSCHEMBL7220213GVHJLVZLFSSQKK-UHFFFAOYSA-Nn1-[1-(4-pyridyl)piperidin-4-ylmethyl]-1,2-benzene-diamine
Database identifiers
- PubChem CID
- 12150698
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 54.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 295
Related reactions
9 records
Compound notes
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