Basic information
- CAS
6635-95-6- Standard SMILES
N=c1ccn(O)cc1CCc1ccccc1- InChIKey
PKFOGCWNVSSACE-UHFFFAOYSA-N- Molecular formula
- C13H14N2O
- Average molar mass
- 214.26 g/mol
- Monoisotopic mass
- 214.11061307
Names & identifiers
- Preferred name
- (4e)-4-Imino-3-(2-phenylethyl)pyridin-1(4h)-ol
- IUPAC
- 1-hydroxy-3-(2-phenylethyl)pyridin-4-imine
Names & synonyms
MLS0026675406635-95-6SMR001557306(4e)-4-imino-3-(2-phenylethyl)pyridin-1(4h)-olNSC524631-hydroxy-3-(2-phenylethyl)pyridin-4-iminecid_243175CHEMBL1886710BDBM87515DTXSID00287778HMS3080K14NSC-52463
Show more names
3-(2-phenylethyl)-4-pyridinamine 1-oxide(1-hydroxy-3-phenethyl-4-pyridylidene)amine1-hydroxy-3-(2-phenylethyl)-4-pyridinimine1-oxidanyl-3-(2-phenylethyl)pyridin-4-imine4-Imino-3-(2-phenylethyl)pyridin-1(4H)-ol
Database identifiers
- CAS
6635-95-6- PubChem CID
- 243175
- DTXSID
DTXSID00287778- ChEMBL
CHEMBL1886710
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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