N-methyl-2-nitro-5-(piperidin-1-yl)aniline
Basic information
- CAS
591735-92-1- Standard SMILES
CNc1cc(N2CCCCC2)ccc1[N+](=O)[O-]- InChIKey
WQIZUZPGLGNQOU-UHFFFAOYSA-N- Molecular formula
- C12H17N3O2
- Average molar mass
- 235.28 g/mol
- Monoisotopic mass
- 235.13207679
Names & identifiers
- Preferred name
- N-methyl-2-nitro-5-(piperidin-1-yl)aniline
- IUPAC
- N-methyl-2-nitro-5-piperidin-1-ylaniline
- English name
- Benzenamine, N-methyl-2-nitro-5-(1-piperidinyl)- (9CI)
- Molecular formula
- C12H17N3O2
- Molecular weight
- 235.28
Names & synonyms
591735-92-1N-methyl-2-nitro-5-(piperidin-1-yl)anilineDTXSID70387916RefChem:364434DTXCID20338938N-methyl-2-nitro-5-piperidin-1-ylanilineSTK157721N-methyl-2-nitro-5-piperidinoanilineAKOS000423409N-methyl-2-nitro-5-(1-piperidinyl)anilineSR-01000263784SR-01000263784-1
Show more names
N-METHYL-2-NITRO-5-(1-PIPERIDINYL)-BENZENAMINEBenzenamine, N-methyl-2-nitro-5-(1-piperidinyl)-Benzenamine, N-methyl-2-nitro-5-(1-piperidinyl)- (9CI)
Database identifiers
- CAS
591735-92-1- PubChem CID
- 2940922
- DTXSID
DTXSID70387916
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 61.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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