Basic information
- Standard SMILES
CC1(CCCCn2ccc(N)n2)OCCO1- InChIKey
HYXJQWFPWHPSEV-UHFFFAOYSA-N- Molecular formula
- C11H19N3O2
- Average molar mass
- 225.29 g/mol
- Monoisotopic mass
- 225.14772686
Names & identifiers
- Preferred name
- 1-[4-(2-Methyl-[1,3]dioxolan-2-yl)-butyl]-1H-pyrazol-3-ylamine
- IUPAC
- 1-[4-(2-methyl-1,3-dioxolan-2-yl)butyl]pyrazol-3-amine
Names & synonyms
1-[4-(2-Methyl-[1,3]dioxolan-2-yl)-butyl]-1H-pyrazol-3-ylamine1163253-75-5SCHEMBL1166436HYXJQWFPWHPSEV-UHFFFAOYSA-NDB-322747
Database identifiers
- PubChem CID
- 66928481
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 219
Related reactions
20 records
Compound notes
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