3,5-dimethoxy-N-(1-methylpyrazol-3-yl)benzamide
Basic information
- CAS
879849-52-2- Standard SMILES
COc1cc(OC)cc(C(=O)Nc2ccn(C)n2)c1- InChIKey
FSLNZRINRJCKKA-UHFFFAOYSA-N- Molecular formula
- C13H15N3O3
- Average molar mass
- 261.28 g/mol
- Monoisotopic mass
- 261.11134135
Names & identifiers
- Preferred name
- 3,5-dimethoxy-N-(1-methylpyrazol-3-yl)benzamide
- IUPAC
- 3,5-dimethoxy-N-(1-methylpyrazol-3-yl)benzamide
Names & synonyms
3,5-dimethoxy-N-(1-methylpyrazol-3-yl)benzamide879849-52-23,5-dimethoxy-N-(1-methyl-1H-pyrazol-3-yl)benzamideMLS001360118CHEMBL1592902DTXSID001330183HMS3063F10STK309510AKOS003746392SMR001224248ST080492Z108544692
Show more names
(3,5-dimethoxyphenyl)-N-(1-methylpyrazol-3-yl)carboxamide
Database identifiers
- CAS
879849-52-2- PubChem CID
- 4776984
- DTXSID
DTXSID001330183- ChEMBL
CHEMBL1592902
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 302
Experimental & physicochemical properties
Solubility28.5 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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