N-(1-Methylpropyl)-1-naphthalenemethanamine
Basic information
- CAS
869944-97-8- Standard SMILES
CCC(C)NCc1cccc2ccccc12- InChIKey
PXXGUEHHAMQZAT-UHFFFAOYSA-N- Molecular formula
- C15H19N
- Average molar mass
- 213.32 g/mol
- Monoisotopic mass
- 213.15174961
Names & identifiers
- Preferred name
- N-(1-Methylpropyl)-1-naphthalenemethanamine
- IUPAC
- N-(naphthalen-1-ylmethyl)butan-2-amine
Names & synonyms
N-(1-Methylpropyl)-1-naphthalenemethanamineSCHEMBL15797480DTXSID801263409AKOS000228433AKOS017269396869944-97-8N-[(Naphthalen-1-yl)methyl]butan-2-amine
Database identifiers
- CAS
869944-97-8- PubChem CID
- 4722263
- DTXSID
DTXSID801263409
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 202
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Compound notes
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