Basic information
- CAS
6000-17-5- Standard SMILES
c1ccc2cc3[nH]c(CN4CCOCC4)nc3cc2c1- InChIKey
ZRSGUNKXJWMIDQ-UHFFFAOYSA-N- Molecular formula
- C16H17N3O
- Average molar mass
- 267.33 g/mol
- Monoisotopic mass
- 267.13716217
Names & identifiers
- Preferred name
- 2-Morpholin-4-ylmethyl-1H-naphtho[2,3-d]imidazole
- IUPAC
- 4-(1H-benzo[f]benzimidazol-2-ylmethyl)morpholine
Names & synonyms
2-Morpholin-4-ylmethyl-1H-naphtho[2,3-d]imidazole4-(1H-benzo[f]benzimidazol-2-ylmethyl)morpholineST0286664-(benzo[f]benzimidazol-2-ylmethyl)morpholine2-[(Morpholin-4-yl)methyl]-1H-naphtho[2,3-d]imidazoleSMR000012328MLS000114134CBMicro_009882Oprea1_104944Oprea1_652022MLS000029622CHEMBL1448310
Show more names
DTXSID00349608HMS2181O08SMSF0010952AKOS000636632CB12763CCG-104664BIM-0009687.P001AK-968/11565114
Database identifiers
- CAS
6000-17-5- PubChem CID
- 655413
- DTXSID
DTXSID00349608- ChEMBL
CHEMBL1448310
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 41.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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