N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-methyl-1-(2-methylpropyl)-1H-pyrazol-4-amine
Basic information
- CAS
1855948-66-1- Standard SMILES
CCn1cc(CNc2cn(CC(C)C)nc2C)cn1- InChIKey
MPWHUUDZFRUSEK-UHFFFAOYSA-N- Molecular formula
- C14H23N5
- Average molar mass
- 261.37 g/mol
- Monoisotopic mass
- 261.19534575
Names & identifiers
- Preferred name
- N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-methyl-1-(2-methylpropyl)-1H-pyrazol-4-amine
- IUPAC
- N-[(1-ethylpyrazol-4-yl)methyl]-3-methyl-1-(2-methylpropyl)pyrazol-4-amine
Names & synonyms
N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-methyl-1-(2-methylpropyl)-1H-pyrazol-4-amine1855948-67-2DTXSID9011296881H-Pyrazole-4-methanamine, 1-ethyl-N-[3-methyl-1-(2-methylpropyl)-1H-pyrazol-4-yl]-1855948-66-1
Database identifiers
- CAS
1855948-66-1- PubChem CID
- 122166830
- DTXSID
DTXSID901129688
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 47.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 271
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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