chempirical

5-Phenyldipyrromethane

C15H14N2CAS 107798-98-1222.29 g/mol

Open in Covalent MOL file
NHHN

Properties

Molecular formula
C15H14N2
Molar mass
222.29 g/mol
Exact mass
222.1157 Da
logP
3.52Crippen estimate
Polar surface area
31.6 Ų
H-bond donors / acceptors
2 / 0
Rotatable bonds
3

Identifiers

CAS number
107798-98-1
SMILES
C1=CC=C(C=C1)C(C2=CC=CN2)C3=CC=CN3
InChIKey
ODOQKWUKLACHRO-UHFFFAOYSA-N
InChI
InChI=1S/C15H14N2/c1-2-6-12(7-3-1)15(13-8-4-10-16-13)14-9-5-11-17-14/h1-11,15-17H

Weigh it out

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

Names and synonyms

9 names
  • 2-[Phenyl(1H-pyrrol-2-yl)methyl]-1H-pyrrole
  • 2,2'-(Phenylmethylene)bis(1h-pyrrole)
  • 2,2'-(Phenylmethylene)bispyrrole
  • 2-[Phenyl-(1H-pyrrol-2-yl)-methyl]-1H-pyrrole
  • 5-(Phenyl)dipyrrylmethane
  • 1H-Pyrrole, 2,2'-(phenylmethylene)bis-
  • 5-(4-Phenyl)dipyrromethane
  • 2,2'-(Phenylmethylene)di(1H-pyrrole)
  • 2,2 Inverted exclamation mark -(Phenylmethylene)bispyrrole

Work with 5-Phenyldipyrromethane

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

Leucomalachite green129-73-734 % similar meso-Stilbene dibromide13440-24-933 % similar trans-Stilbene oxide1439-07-233 % similar Rel-(1R,2R)-1,2-diphenyl-1,2-ethanediamine16635-95-333 % similar (-)-(S,S)-1,2-Diphenylethylenediamine29841-69-833 % similar Diphenylethylenediamine35132-20-833 % similar Pyrrole-2-carbonitrile4513-94-433 % similar Rel-(1R,2S)-1,2-diphenyl-1,2-ethanediol579-43-133 % similar

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

Same formula

6-Methyl-2-(4-methylphenyl)imidazo[1,2-A]pyridine88965-00-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook