1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea
Basic information
- CAS
99616-27-0- Standard SMILES
CN(C)C(=S)NNCc1ccccn1- InChIKey
JGBFJQROHDPTHL-UHFFFAOYSA-N- Molecular formula
- C9H14N4S
- Average molar mass
- 210.3 g/mol
- Monoisotopic mass
- 210.09391764
Names & identifiers
- Preferred name
- 1,1-Dimethyl-3-(pyridin-2-ylmethylamino)thiourea
- IUPAC
- 1,1-dimethyl-3-(pyridin-2-ylmethylamino)thiourea
Names & synonyms
1,1-dimethyl-3-(pyridin-2-ylmethylamino)thiourea99616-27-0DTXSID00244169N,N-Dimethyl-2-[(pyridin-2-yl)methyl]hydrazine-1-carbothioamide
Database identifiers
- CAS
99616-27-0- PubChem CID
- 3037585
- DTXSID
DTXSID00244169- Nikkaji
- J372.903F
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 72.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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