2-[3-(Dimethylamino)propyl]-1-nitroguanidine
Basic information
- CAS
5461-84-7- Standard SMILES
CN(C)CCCN=C(N)N[N+](=O)[O-]- InChIKey
FUDIQBABQNEIDA-UHFFFAOYSA-N- Molecular formula
- C6H15N5O2
- Average molar mass
- 189.22 g/mol
- Monoisotopic mass
- 189.12257474
Names & identifiers
- Preferred name
- 2-[3-(Dimethylamino)propyl]-1-nitroguanidine
- IUPAC
- 2-[3-(dimethylamino)propyl]-1-nitroguanidine
Names & synonyms
5461-84-7DTXSID30969878N-[3-(Dimethylamino)propyl]-N'-nitroguanidine
Database identifiers
- CAS
5461-84-7- PubChem CID
- 409904
- DTXSID
DTXSID30969878
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 99.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 186
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Compound notes
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