1-ethyl-N-[(1-ethyl-5-fluoro-3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amine
Basic information
- CAS
1855937-11-9- Standard SMILES
CCn1cc(NCc2c(C)nn(CC)c2F)cn1- InChIKey
LITAFCBCIGOFGP-UHFFFAOYSA-N- Molecular formula
- C12H18FN5
- Average molar mass
- 251.3 g/mol
- Monoisotopic mass
- 251.15462376
Names & identifiers
- Preferred name
- 1-ethyl-N-[(1-ethyl-5-fluoro-3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amine
- IUPAC
- 1-ethyl-N-[(1-ethyl-5-fluoro-3-methylpyrazol-4-yl)methyl]pyrazol-4-amine
Names & synonyms
1-ethyl-N-[(1-ethyl-5-fluoro-3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amineDTXSID901132138AKOS0408910201H-Pyrazole-4-methanamine, 1-ethyl-N-(1-ethyl-1H-pyrazol-4-yl)-5-fluoro-3-methyl-1855937-11-9
Database identifiers
- CAS
1855937-11-9- PubChem CID
- 122169264
- DTXSID
DTXSID901132138
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 47.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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