Trans-(+/-)-2-dimethylamino-6-n-propyl-5,5a,-6,7,8,9,9a,10-octahydropyrimido[4,5-g]quinoline
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Basic information
- Standard SMILES
CCCN1CCC[C@H]2Cc3nc(N(C)C)ncc3C[C@@H]21- InChIKey
MSDSRFAMXSICJP-WFASDCNBSA-N- Molecular formula
- C16H26N4
- Average molar mass
- 274.4 g/mol
- Monoisotopic mass
- 274.21574685
Names & identifiers
- Preferred name
- Trans-(+/-)-2-dimethylamino-6-n-propyl-5,5a,-6,7,8,9,9a,10-octahydropyrimido[4,5-g]quinoline
- IUPAC
- (5aS,9aS)-N,N-dimethyl-6-propyl-5a,7,8,9,9a,10-hexahydro-5H-pyrido[2,3-g]quinazolin-2-amine
Names & synonyms
SCHEMBL7274010MSDSRFAMXSICJP-WFASDCNBSA-NTrans-(+/-)-2-dimethylamino-6-n-propyl-5,5a,-6,7,8,9,9a,10-octahydropyrimido[4,5-g]quinolineTrans-(+/-)-2-dimethylamino-6-n-propyl-5,5a,6,7,8,9,9a,10-octahydropyrimido[4,5-g]quinoline
Database identifiers
- PubChem CID
- 18596285
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
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Related reactions
2 records
Compound notes
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