Basic information
- CAS
511517-47-8- Standard SMILES
Cc1ccn(C(=O)c2ccc(NC(=O)C3CC3)cc2)n1- InChIKey
PJCNNNQDCAMAOU-UHFFFAOYSA-N- Molecular formula
- C15H15N3O2
- Average molar mass
- 269.3 g/mol
- Monoisotopic mass
- 269.11642673
Names & identifiers
- Preferred name
- N-[4-(3-methylpyrazole-1-carbonyl)phenyl]cyclopropanecarboxamide
- IUPAC
- N-[4-(3-methylpyrazole-1-carbonyl)phenyl]cyclopropanecarboxamide
Names & synonyms
N-[4-(3-methylpyrazole-1-carbonyl)phenyl]cyclopropanecarboxamide511517-47-8N-{4-[(3-methyl-1H-pyrazol-1-yl)carbonyl]phenyl}cyclopropanecarboxamideMLS000717719SMR000287435N-(4-(3-methyl-1H-pyrazole-1-carbonyl)phenyl)cyclopropanecarboxamideSR-01000731165N-[4-(3-methyl-1H-pyrazole-1-carbonyl)phenyl]cyclopropanecarboxamideOprea1_763308F1443-3899IFLab1_005711CHEMBL1351670
Show more names
DTXSID401322835HMS1428D13HMS2677O12STK060101AKOS000494230IDI1_011114AN-329/41689975SR-01000731165-2
Database identifiers
- CAS
511517-47-8- PubChem CID
- 833522
- DTXSID
DTXSID401322835- ChEMBL
CHEMBL1351670
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 64 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 387
Experimental & physicochemical properties
Solubility17.4 [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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