3-(2,5-dimethylphenyl)-1H-pyrazol-5-amine
Basic information
- CAS
501902-68-7- Standard SMILES
Cc1ccc(C)c(-c2cc(N)n[nH]2)c1- InChIKey
DOKNEPPEEBJNJR-UHFFFAOYSA-N- Molecular formula
- C11H13N3
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.11094743
Names & identifiers
- Preferred name
- 3-(2,5-dimethylphenyl)-1H-pyrazol-5-amine
- IUPAC
- 5-(2,5-dimethylphenyl)-1H-pyrazol-3-amine
Names & synonyms
3-(2,5-dimethylphenyl)-1H-pyrazol-5-amine501902-68-75-(2,5-dimethylphenyl)-1H-pyrazol-3-amineDTXSID401262542STK895540AKOS000188138EN300-714971H-Pyrazol-3-amine, 5-(2,5-dimethylphenyl)-
Database identifiers
- CAS
501902-68-7- PubChem CID
- 3296100
- DTXSID
DTXSID401262542
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 195
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