chempirical

Nimetazepam

C16H13N3O3CAS 2011-67-8295.30 g/mol

Open in Covalent MOL file
NONN+OO−
AmideImineLactamNitro

Properties

Molecular formula
C16H13N3O3
Molar mass
295.30 g/mol
Exact mass
295.0957 Da
Melting point
7.5–156.5 °C
logP
2.41Crippen estimate
Polar surface area
75.8 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P273, P301+P317, P330, P391, P501

Identifiers

CAS number
2011-67-8
SMILES
CN1C(=O)CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc21
InChIKey
GWUSZQUVEVMBPI-UHFFFAOYSA-N
InChI
InChI=1S/C16H13N3O3/c1-18-14-8-7-12(19(21)22)9-13(14)16(17-10-15(18)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3

Weigh it out

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

Names and synonyms

15 names · show all
  • 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-1-methyl-7-nitro-5-phenyl-
  • 1,3-Dihydro-1-methyl-7-nitro-5-phenyl-2H-1,4-benzodiazepin-2-one
  • S 1530
  • 1-Methyl-5-phenyl-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one
  • Ro 5-3453
  • N-Methylmogadon
  • Methylnitrazepam
  • Elimin
  • N-Methylnitrazepam
  • Erimin
  • 1-Methylnitrazepam
  • Nimetazam
  • Hypnon
  • 1-Methyl-7-nitro-5-phenyl-1H-1,4-benzodiazepin-2(3H)-one
  • 1-Methyl-7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-one

Work with Nimetazepam

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

Diazepam439-14-565 % similar Nitrazepam146-22-555 % similar Chlorodiazepam2894-68-050 % similar 2-Amino-5-nitrobenzophenone1775-95-743 % similar 2-Chloro-5-nitrobenzophenone34052-37-443 % similar 2-Chloro-N-methyl-N-(4-nitro-phenyl)-acetamide2653-16-943 % similar 2-Methyl-5-nitro-1H-isoindole-1,3(2H)-dione41663-84-741 % similar Clonazepam1622-61-341 % similar

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

Same formula

Mebendazole31431-39-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook