Octahydro-quinolizine-1-carboxylic acid

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Basic information

CAS: 90978-66-8
Standard SMILES: O=C(O)C1CCCN2CCCCC12
InChIKey: ZYQJGZAVMHNFNY-UHFFFAOYSA-N
Molecular formula: C10H17NO2
Average molar mass: 183.25 g/mol
Monoisotopic mass: 183.12592879

Names & identifiers

Preferred name: Octahydro-quinolizine-1-carboxylic acid
IUPAC: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylic acid

Names & synonyms

octahydro-quinolizine-1-carboxylic acid90978-66-8DTXSID70339733RefChem:366777DTXCID10290814Lupininic acid2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylic acidOctahydro-2H-quinolizine-1-carboxylic acidstarbld0001196SCHEMBL4037708ALBB-030781AKOS015938849

Show more names

SB45177

Database identifiers

CAS: 90978-66-8
PubChem CID: 558135
DTXSID: DTXSID70339733

Properties

Computed structural properties

XLogP: -1.1
Topological polar surface area: 40.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 205

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Compound notes

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