Basic information
- CAS
3582-42-1- Standard SMILES
CC(C)C(C#N)(CCN(C)C)c1ccc2ccccc2c1- InChIKey
YPOZUUUUPHSOOI-UHFFFAOYSA-N- Molecular formula
- C19H24N2
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.19394877
Names & identifiers
- Preferred name
- 2-Naphthaleneacetonitrile, alpha-(2-(dimethylamino)ethyl)-alpha-isopropyl-
- IUPAC
- 2-[2-(dimethylamino)ethyl]-3-methyl-2-naphthalen-2-ylbutanenitrile
- English name
- α-[2-(Dimethylamino)ethyl]-α-isopropyl-2-naphthaleneacetonitrile
- Molecular formula
- C19H24N2
- Molecular weight
- 280.40726
Names & synonyms
BRN 27491263582-42-1alpha-Isopropyl-alpha-(2-dimethylaminoethyl)-2-naphthylacetonitrileButyronitrile, 4-dimethylamino-2-isopropyl-2-(2-naphthyl)-Butyronitrile, 2-(2-dimethylaminoethyl)-3-methyl-2-(2-naphthyl)-2-NAPHTHALENEACETONITRILE, alpha-(2-(DIMETHYLAMINO)ETHYL)-alpha-ISOPROPYL-RefChem:264114DTXSID309572302-[2-(DIMETHYLAMINO)ETHYL]-3-METHYL-2-(NAPHTHALEN-2-YL)BUTANENITRILEα-[2-(Dimethylamino)ethyl]-α-isopropyl-2-naphthaleneacetonitrile
Database identifiers
- CAS
3582-42-1- PubChem CID
- 19159
- DTXSID
DTXSID30957230- Nikkaji
- J42.405F
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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