1-Methyl-3-(((1-methyl-1H-pyrazol-4-yl)methyl)carbamoyl)-1H-pyrazole-4-carboxylic acid
Basic information
- CAS
1006441-05-9- Standard SMILES
Cn1cc(CNC(=O)c2nn(C)cc2C(=O)O)cn1- InChIKey
GMFJDSQPIALAES-UHFFFAOYSA-N- Molecular formula
- C11H13N5O3
- Average molar mass
- 263.25 g/mol
- Monoisotopic mass
- 263.10183929
Names & identifiers
- Preferred name
- 1-Methyl-3-(((1-methyl-1H-pyrazol-4-yl)methyl)carbamoyl)-1H-pyrazole-4-carboxylic acid
- IUPAC
- 1-methyl-3-[(1-methylpyrazol-4-yl)methylcarbamoyl]pyrazole-4-carboxylic acid
Names & synonyms
1006441-05-91-Methyl-3-(((1-methyl-1H-pyrazol-4-yl)methyl)carbamoyl)-1H-pyrazole-4-carboxylic acid1-Methyl-3-(((1-methyl-1H-pyrazol-4-yl)methyl)carbamoyl)-1H-pyrazole-4-carboxylicacid1H-Pyrazole-4-carboxylic acid, 1-methyl-3-[[[(1-methyl-1H-pyrazol-4-yl)methyl]amino]carbonyl]-1-Methyl-3-{[(1-methyl-1H-pyrazol-4-yl)methyl]carbamoyl}-1H-pyrazole-4-carboxylic acidDTXSID40599145AKOS000315432DB-328971
Database identifiers
- CAS
1006441-05-9- PubChem CID
- 19623967
- DTXSID
DTXSID40599145
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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