1-(4-Nitrophenyl)piperidine

C11H14N2O2CAS 6574-15-8206.24 g/mol

Open in Covalent MOL file
ON+O−N
NitroTertiary amine

Properties

Molecular formula
C11H14N2O2
Molar mass
206.24 g/mol
Exact mass
206.1055 Da
Melting point
114 °C
logP
2.59Crippen estimate
Polar surface area
46.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
6574-15-8
SMILES
O=[N+]([O-])c1ccc(N2CCCCC2)cc1
InChIKey
SGPLAXFUDTWHRS-UHFFFAOYSA-N
InChI
InChI=1S/C11H14N2O2/c14-13(15)11-6-4-10(5-7-11)12-8-2-1-3-9-12/h4-7H,1-3,8-9H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • Piperidine, 1-(4-nitrophenyl)-
  • Piperidine, 1-(p-nitrophenyl)-
  • N-(p-Nitrophenyl)piperidine
  • p-(1-Piperidinyl)nitrobenzene
  • p-Nitropiperidinobenzene
  • 4-Piperidinonitrobenzene
  • N-(4-Nitrophenyl)piperidine
  • 1-(p-Nitrophenyl)piperidine
  • NSC 15441

Work with 1-(4-Nitrophenyl)piperidine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-(4-Nitrophenyl)morpholine10389-51-270 % similar 1-(4-Nitrophenyl)piperazine6269-89-270 % similar 4-[4-(4-Nitrophenyl)-1-piperazinyl]phenol112559-81-668 % similar 1-Methyl-4-(4-nitrophenyl)piperazine16155-03-668 % similar N,N-Diethyl-4-nitrobenzenamine2216-15-164 % similar 1-(4-Methoxyphenyl)-4-(4-nitrophenyl)piperazine74852-61-262 % similar 4-Nitro-N,N-bis(4-nitrophenyl)benzenamine20440-93-160 % similar 1-(4-Nitrophenyl)piperidin-2-one38560-30-456 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Phenylmethyl 3-amino-1-azetidinecarboxylate112257-20-2 Dimezone S13047-13-7 1-Butyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarbonitrile39108-47-9 (4-Aminophenyl)(morpholino)methanone51207-86-4 1-Ethyl-7-nitro-1,2,3,4-tetrahydroquinoline57883-28-0 Phenylethylmalonamide7206-76-0 N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide86847-64-5 3-(Cbz-amino)-azetidine914348-04-2

Elsewhere

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