Basic information
- CAS
179116-11-1- Standard SMILES
CN(C)CCCNC1=NCCCS1- InChIKey
CUZOTQMKXOWRPQ-UHFFFAOYSA-N- Molecular formula
- C9H19N3S
- Average molar mass
- 201.33 g/mol
- Monoisotopic mass
- 201.12996879
Names & identifiers
- Preferred name
- N3-(5,6-Dihydro-4H-1,3-thiazin-2-yl)-N1,N1-dimethyl-1,3-propanediamine
- IUPAC
- N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N',N'-dimethylpropane-1,3-diamine
Names & synonyms
DTXSID801154369179116-11-1N3-(5,6-Dihydro-4H-1,3-thiazin-2-yl)-N1,N1-dimethyl-1,3-propanediamineN~3~-(5,6-Dihydro-4H-1,3-thiazin-2-yl)-N~1~,N~1~-dimethylpropane-1,3-diamine
Database identifiers
- CAS
179116-11-1- PubChem CID
- 29068288
- DTXSID
DTXSID801154369
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 168
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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