5-((2-Aminocyclohexyl)methyl)-o-toluidine
Basic information
- CAS
94166-81-1- Standard SMILES
Cc1ccc(CC2CCCCC2N)cc1N- InChIKey
NUJPGASUAKAPHT-UHFFFAOYSA-N- Molecular formula
- C14H22N2
- Average molar mass
- 218.34 g/mol
- Monoisotopic mass
- 218.17829871
Names & identifiers
- Preferred name
- 5-((2-Aminocyclohexyl)methyl)-o-toluidine
- IUPAC
- 5-[(2-aminocyclohexyl)methyl]-2-methylaniline
- English name
- 5-[(2-aminocyclohexyl)methyl]-o-toluidine
- Molecular formula
- C14H22N2
- Molecular weight
- 218.34
Names & synonyms
EINECS 303-379-35-((2-Aminocyclohexyl)methyl)-o-toluidine94166-81-15-[(2-aminocyclohexyl)methyl]-2-methylanilineSCHEMBL10625068DTXSID70916205NUJPGASUAKAPHT-UHFFFAOYSA-NNS000667195-[(2-aminocyclohexyl)methyl]-o-toluidine5-[(2-Aminocyclohexyl)methyl]-2-methylbenzenamineBenzenamine, 5-[(2-aminocyclohexyl)methyl]-2-methyl-
Database identifiers
- CAS
94166-81-1- PubChem CID
- 3023930
- DTXSID
DTXSID70916205- EC Number
- 303-379-3
- Nikkaji
- J319.036F
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 217
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Compound notes
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