chempirical

Nitenpyram

C11H15ClN4O2CAS 150824-47-8270.72 g/mol

Open in Covalent MOL file
NClNN+OO−HN
AlkeneAryl halideNitroSecondary amineTertiary amine

Properties

Molecular formula
C11H15ClN4O2
Molar mass
270.72 g/mol
Exact mass
270.0884 Da
logP
1.85Crippen estimate
Polar surface area
71.3 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
6
Double bonds
EE/Z, in SMILES order

Identifiers

CAS number
150824-47-8
SMILES
CCN(Cc1ccc(Cl)nc1)/C(=C/[N+](=O)[O-])NC
InChIKey
CFRPSFYHXJZSBI-DHZHZOJOSA-N
InChI
InChI=1S/C11H15ClN4O2/c1-3-15(11(13-2)8-16(17)18)7-9-4-5-10(12)14-6-9/h4-6,8,13H,3,7H2,1-2H3/b11-8+

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Names and synonyms

9 names
  • 1,1-Ethenediamine, N-[(6-chloro-3-pyridinyl)methyl]-N-ethyl-N′-methyl-2-nitro-, (1E)-
  • 1,1-Ethenediamine, N-[(6-chloro-3-pyridinyl)methyl]-N-ethyl-N′-methyl-2-nitro-, (E)-
  • (1E)-N-[(6-Chloro-3-pyridinyl)methyl]-N-ethyl-N′-methyl-2-nitro-1,1-ethenediamine
  • (E)-Nitenpyram
  • TI 304
  • Bestguard
  • Niterndipoine
  • Capstar
  • (E)-N-(6-Chloro-3-pyridylmethyl)-N-ethyl-N′-methyl-2-nitroethylene-1,1-diamine

Work with Nitenpyram

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

1-[(6-Chloro-3-pyridinyl)methyl]-4,5-dihydro-N-nitro-1H-imidazol-2-amine105827-78-945 % similar Imidacloprid138261-41-345 % similar 2-Chloro-5-(chloromethyl)pyridine70258-18-335 % similar Thiacloprid111988-49-934 % similar Acetamiprid135410-20-733 % similar N-[(6-Chloro-3-pyridinyl)methyl]-N′-cyano-N-methylethanimidamide160430-64-833 % similar 2-Chloro-5-nitropyridine4548-45-233 % similar Ranitidine66357-35-532 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-[(6-Chloro-3-pyridinyl)methyl]-N-ethyl-N′-methyl-2-nitro-1,1-ethenediamine120738-89-8

Elsewhere

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