2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanimidamide
Basic information
- CAS
7510-16-9- Standard SMILES
COc1ccc2[nH]c(C)c(CC(=N)N)c2c1- InChIKey
NKDQEPJFTZJKHP-UHFFFAOYSA-N- Molecular formula
- C12H15N3O
- Average molar mass
- 217.27 g/mol
- Monoisotopic mass
- 217.12151211
Names & identifiers
- Preferred name
- 2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanimidamide
- IUPAC
- 2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanimidamide
Names & synonyms
7510-16-92-(5-methoxy-2-methyl-1H-indol-3-yl)ethanimidamideNSC405602(1Z)-2-(5-Methoxy-2-methyl-1H-indol-3-yl)ethanimidamideDTXSID20324058NSC-405602(5-Methoxy-2-methyl-1H-indol-3-yl)ethanimidamide
Database identifiers
- CAS
7510-16-9- PubChem CID
- 347111
- DTXSID
DTXSID20324058
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 269
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Compound notes
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