N-[(2-methoxynaphthalen-1-yl)methyl]-1-methyltetrazol-5-amine
Basic information
- CAS
717833-84-6- Standard SMILES
COc1ccc2ccccc2c1CNc1nnnn1C- InChIKey
RQQINYNYMNUEPL-UHFFFAOYSA-N- Molecular formula
- C14H15N5O
- Average molar mass
- 269.3 g/mol
- Monoisotopic mass
- 269.12766012
Names & identifiers
- Preferred name
- N-[(2-methoxynaphthalen-1-yl)methyl]-1-methyltetrazol-5-amine
- IUPAC
- N-[(2-methoxynaphthalen-1-yl)methyl]-1-methyltetrazol-5-amine
Names & synonyms
N-[(2-methoxynaphthalen-1-yl)methyl]-1-methyltetrazol-5-amine717833-84-6N-[(2-methoxy-1-naphthyl)methyl]-1-methyl-1H-tetrazol-5-amineN-[(2-methoxynaphthalen-1-yl)methyl]-1-methyl-1H-tetrazol-5-amineN-((2-methoxynaphthalen-1-yl)methyl)-1-methyl-1H-tetrazol-5-amineMLS000664662CHEMBL1332288DTXSID901325191HMS2722D20STK511363AKOS000284456SMR000296393
Show more names
AN-465/42886187SR-01000296526SR-01000296526-1N-[(2-methoxy-1-naphthyl)methyl]-N-(1-methyl-1H-tetraazol-5-yl)amine
Database identifiers
- CAS
717833-84-6- PubChem CID
- 834540
- DTXSID
DTXSID901325191- ChEMBL
CHEMBL1332288
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Experimental & physicochemical properties
Solubility27.4 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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