Basic information
- Standard SMILES
Cc1cc(-c2ccco2)n[nH]1- InChIKey
VVSHKLXYBAYORP-UHFFFAOYSA-N- Molecular formula
- C8H8N2O
- Average molar mass
- 148.16 g/mol
- Monoisotopic mass
- 148.06366288
Names & identifiers
- Preferred name
- 5-(2-Furyl)-3-methyl-1H-pyrazole
- IUPAC
- 3-(furan-2-yl)-5-methyl-1H-pyrazole
Names & synonyms
5-(furan-2-yl)-3-methyl-1H-pyrazoleCHEMBL37466475-(2-Furyl)-3-methyl-1H-pyrazoleSCHEMBL2736625SCHEMBL7381430SCHEMBL79144183-furan-2-yl-5-methylpyrazoleVVSHKLXYBAYORP-UHFFFAOYSA-NBDBM50500498STK325840AKOS000588821NCGC00323308-01
Show more names
AB01318866-02
Database identifiers
- PubChem CID
- 700124
- ChEMBL
CHEMBL3746647- Nikkaji
- J2.365.069J
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Related reactions
1 records
Linked notes
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