1-(1H-Pyrazol-3-YL)propan-2-amine
Basic information
- CAS
1017783-22-0- Standard SMILES
CC(N)Cc1ccn[nH]1- InChIKey
KCYGESYSBXWUJF-UHFFFAOYSA-N- Molecular formula
- C6H11N3
- Average molar mass
- 125.17 g/mol
- Monoisotopic mass
- 125.09529736
Names & identifiers
- Preferred name
- 1-(1H-Pyrazol-3-YL)propan-2-amine
- IUPAC
- 1-(1H-pyrazol-5-yl)propan-2-amine
- English name
- 1-(1H-pyrazol-3-yl)propan-2-amine
- Molecular formula
- C6H11N3
- Molecular weight
- 125.17
Names & synonyms
1-(1H-PYRAZOL-3-YL)PROPAN-2-AMINE1017783-22-01-(1H-pyrazol-5-yl)propan-2-amineSCHEMBL28929855DTXSID70677501AKOS010608816DB-011791I11135EN300-1695973Betazole Hydrochloride Impurity 11H-Pyrazole-3-ethanamine, α-methyl-1H-Pyrazole-3-ethanaMine, a-Methyl-
Database identifiers
- CAS
1017783-22-0- PubChem CID
- 46942004
- DTXSID
DTXSID70677501
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 84.4
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