Basic information
- CAS
37989-10-9- Standard SMILES
Cl.Nc1nc(N2CCCC2)cc2ccccc12- InChIKey
QBHKIULRLFVDOS-UHFFFAOYSA-N- Molecular formula
- C13H16ClN3
- Average molar mass
- 249.74 g/mol
- Monoisotopic mass
- 249.1032752
Names & identifiers
- Preferred name
- Isoquinoline, 1-amino-3-(1-pyrrolidinyl)-, monohydrochloride
- IUPAC
- 3-pyrrolidin-1-ylisoquinolin-1-amine;hydrochloride
- English name
- 1-Amino-3-(1-pyrrolidinyl)isoquinoline monohydrochloride
- Molecular weight
- 0
Names & synonyms
37989-10-9Isoquinoline, 1-amino-3-(1-pyrrolidinyl)-, monohydrochloride1-Amino-3-(1-pyrrolidinyl)isoquinoline monohydrochloride1-Isoquinolinamine, 3-(1-pyrrolidinyl)-, monohydrochlorideDTXSID30191415RefChem:349984DTXCID401139061-amino-3-(pyrrolidin-1-yl)isoquinoline hydrochloride3-(Pyrrolidin-1-yl)isoquinolin-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
37989-10-9- PubChem CID
- 217009
- DTXSID
DTXSID30191415
Properties
Computed structural properties
- Topological polar surface area
- 42.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 237
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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