chempirical

2-Amino-5-phenyl-1,3,4-oxadiazole

C8H7N3OCAS 1612-76-6161.16 g/mol

Open in Covalent MOL file
HNHNNO

Properties

Molecular formula
C8H7N3O
Molar mass
161.16 g/mol
Exact mass
161.0589 Da
Melting point
242 °C
logP
1.15Crippen estimate
Polar surface area
65.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
1612-76-6
SMILES
N=c1[nH]nc(-c2ccccc2)o1
InChIKey
CQSFYCBGVMWPCM-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N3O/c9-8-11-10-7(12-8)6-4-2-1-3-5-6/h1-5H,(H2,9,11)

Weigh it out

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

Names and synonyms

5 names
  • 1,3,4-Oxadiazol-2-amine, 5-phenyl-
  • 1,3,4-Oxadiazole, 2-amino-5-phenyl-
  • 5-Phenyl-1,3,4-oxadiazol-2-amine
  • 5-Phenyl-1,3,4-oxadiazol-2-ylamine
  • NSC 116132

Work with 2-Amino-5-phenyl-1,3,4-oxadiazole

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

5-(2-Furanyl)-1,3,4-oxadiazol-2-amine7659-06-556 % similar 2,5-Diphenyl-1,3,4-oxadiazole725-12-245 % similar 2-(4-Biphenylyl)-5-phenyl-1,3,4-oxadiazole852-38-042 % similar 2,5-Diphenyloxazole92-71-738 % similar Popop1806-34-437 % similar 5-Phenyl-1,3,4-oxadiazole-2-thiol3004-42-037 % similar 2-Phenylbenzoxazole833-50-137 % similar 2,5-Bis(4-biphenylyl)oxazole2083-09-236 % similar

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

Same formula

1-Cyano-3-phenylurea41834-91-7 1-Phenyl-3-hydroxy-1,2,4-triazole4231-68-9 4-(1,2,4-Triazol-1-yl)phenol68337-15-5

Elsewhere

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