N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazol-4-amine
Basic information
- CAS
1006961-97-2- Standard SMILES
COc1ccc(CNc2cnn(C)c2)c(OC)c1- InChIKey
QXNOZWLZRIMZJO-UHFFFAOYSA-N- Molecular formula
- C13H17N3O2
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.13207679
Names & identifiers
- Preferred name
- N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazol-4-amine
- IUPAC
- N-[(2,4-dimethoxyphenyl)methyl]-1-methylpyrazol-4-amine
Names & synonyms
N-[(2,4-dimethoxyphenyl)methyl]-1-methyl-1H-pyrazol-4-amine1006961-97-2N-[(2,4-dimethoxyphenyl)methyl]-1-methylpyrazol-4-amineGQB96197AKOS000317188CS-0263873EN300-90468G48745
Database identifiers
- CAS
1006961-97-2- PubChem CID
- 19625713
- EC Number
- 190-915-2
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 48.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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