Basic information
- CAS
13326-37-9- Standard SMILES
N#CC(CCCN1CCOCC1)c1cccc2ccccc12- InChIKey
REAMLHVXFBJQJS-UHFFFAOYSA-N- Molecular formula
- C19H22N2O
- Average molar mass
- 294.4 g/mol
- Monoisotopic mass
- 294.17321333
Names & identifiers
- Preferred name
- 1-Naphthaleneacetonitrile, alpha-(3-(morpholino)propyl)-
- IUPAC
- 5-morpholin-4-yl-2-naphthalen-1-ylpentanenitrile
- English name
- α-(1-Naphtyl)-4-morpholinevaleronitrile
- Molecular formula
- C19H22N2O
- Molecular weight
- 294.39
Names & synonyms
13326-37-91-NAPHTHALENEACETONITRILE, alpha-(3-(MORPHOLINO)PROPYL)-RefChem:1055958alpha-(1-Naphtyl)-4-morpholinevaleronitrileBRN 11370025-morpholin-4-yl-2-naphthalen-1-ylpentanenitrile4-Morpholinevaleronitrile, alpha-1-naphthyl-alpha-(3-Morpholinopropyl)-1-naphthaleneacetonitrile5-(Morpholin-4-yl)-2-(naphthalen-1-yl)pentanenitrileDTXSID70928025α-(1-Naphtyl)-4-morpholinevaleronitrile4-Morpholinepentanenitrile, α-1-naphthalenyl-
Database identifiers
- CAS
13326-37-9- PubChem CID
- 25875
- DTXSID
DTXSID70928025- Nikkaji
- J42.420J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 382
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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