N-(3-nitrobenzyl)cyclopentanamine
Basic information
- CAS
355382-02-4- Standard SMILES
O=[N+]([O-])c1cccc(CNC2CCCC2)c1- InChIKey
QUQQPZINNSKFTE-UHFFFAOYSA-N- Molecular formula
- C12H16N2O2
- Average molar mass
- 220.27 g/mol
- Monoisotopic mass
- 220.12117776
Names & identifiers
- Preferred name
- N-(3-nitrobenzyl)cyclopentanamine
- IUPAC
- N-[(3-nitrophenyl)methyl]cyclopentanamine
- English name
- N-(3-nitrobenzyl)cyclopentanamine
- Molecular formula
- C12H16N2O2
- Molecular weight
- 220.27
Names & synonyms
N-(3-nitrobenzyl)cyclopentanamine355382-02-4N-[(3-nitrophenyl)methyl]cyclopentanamineN-Cyclopentyl-3-nitrobenzenemethanamineCBMicro_024901Cambridge id 5566116Oprea1_203968Oprea1_558885DTXSID90355117BBL013828CCG-11875MFCD01135391
Show more names
UKRORGSYN-BB BBV-144370CYCLOPENTYL-(3-NITRO-BENZYL)-AMINEBenzenemethanamine, N-cyclopentyl-3-nitro-N-(3-nitrobenzyl)cyclopentanamine(SALTDATA: HBr)
STK129923AKOS000252949cyclopentyl[(3-nitrophenyl)methyl]amineBIM-0024822.P001DB-265747CS-0327587ST45112656AG-690/11822480
Database identifiers
- CAS
355382-02-4- PubChem CID
- 791883
- DTXSID
DTXSID90355117
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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