Basic information
- Standard SMILES
COC(c1ccc(C(F)(F)F)cc1CNc1nnn(C)n1)C1CCCCC1- InChIKey
YRSJXCGVEWQLJG-UHFFFAOYSA-N- Molecular formula
- C18H24F3N5O
- Average molar mass
- 383.4 g/mol
- Monoisotopic mass
- 383.19329489
Names & identifiers
- Preferred name
- [2-(cyclohexyl-methoxy-methyl)-5-trifluoromethyl-benzyl]-(2-methyl-2H-tetrazol-5-yl)-amine
- IUPAC
- N-[[2-[cyclohexyl(methoxy)methyl]-5-(trifluoromethyl)phenyl]methyl]-2-methyltetrazol-5-amine
Names & synonyms
[2-(cyclohexyl-methoxy-methyl)-5-trifluoromethyl-benzyl]-(2-methyl-2H-tetrazol-5-yl)-amineSCHEMBL1600489
Database identifiers
- PubChem CID
- 58968679
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 461
Related reactions
3 records
Compound notes
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