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Basic information
- Standard SMILES
CNc1ccccc1OCCc1nnn[nH]1- InChIKey
PERMPJUILHGBIA-UHFFFAOYSA-N- Molecular formula
- C10H13N5O
- Average molar mass
- 219.24 g/mol
- Monoisotopic mass
- 219.11201006
Names & identifiers
- Preferred name
- Methyl-{2-[2-(1H-tetrazol-5-yl)-ethoxy]-phenyl}-amine
- IUPAC
- N-methyl-2-[2-(2H-tetrazol-5-yl)ethoxy]aniline
Names & synonyms
SCHEMBL3338194PERMPJUILHGBIA-UHFFFAOYSA-NMethyl-{2-[2-(1H-tetrazol-5-yl)-ethoxy]-phenyl}-amine
Database identifiers
- PubChem CID
- 68603032
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 204
Related reactions
8 records
Compound notes
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