2-(2,2-dibromo-1-phenylethenyl)pyridine

C13H9Br2N — CID 139230167

IUPAC2-(2,2-dibromo-1-phenylethenyl)pyridine
SMILESBrC(Br)=C(c1ccccc1)c1ccccn1
InChIInChI=1S/C13H9Br2N/c14-13(15)12(10-6-2-1-3-7-10)11-8-4-5-9-16-11/h1-9H
InChIKeyHCDWFXHNTIEDBP-UHFFFAOYSA-N
MW339.03 g/mol
LogP4.59
Rot. Bonds2

About 2-(2,2-dibromo-1-phenylethenyl)pyridine

2-(2,2-dibromo-1-phenylethenyl)pyridine (PubChem CID 139230167) has the molecular formula C13H9Br2N and a molecular weight of 339.03 g/mol. Its IUPAC name is 2-(2,2-dibromo-1-phenylethenyl)pyridine.

Molecular Properties

Compound Name2-(2,2-dibromo-1-phenylethenyl)pyridine
PubChem CID139230167
Molecular FormulaC13H9Br2N
Molecular Weight339.03 g/mol
Exact Mass336.91
IUPAC Name2-(2,2-dibromo-1-phenylethenyl)pyridine
SMILESBrC(Br)=C(c1ccccc1)c1ccccn1
InChIInChI=1S/C13H9Br2N/c14-13(15)12(10-6-2-1-3-7-10)11-8-4-5-9-16-11/h1-9H
InChIKeyHCDWFXHNTIEDBP-UHFFFAOYSA-N
XLogP4.59
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.03
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-amino-3-phenyl-2-pyridin-2-ylprop-2-enenitrile
CID 4114741
(NZ)-N-[phenyl(pyridin-2-yl)methylidene]hydroxylamine
CID 135427108
gadolinium;pyridine-2-carboxylic acid
CID 175231422
2-phenyl-2-pyridin-2-ylethenimine
CID 139237404
tetrakis(pyridine);1,2,2-triphenylethenylbenzene
CID 175604996
1-pyridin-2-ylethanethione
CID 89010255
pyridine-2-carboxylic acid;tungsten
CID 88770661
CID 173156131
CID 173156131
hafnium;pyridine-2-carboxylic acid
CID 175130925
CID 175246691
CID 175246691
europium;pyridine-2-carboxylic acid
CID 174808227
cerium(3+);tris(N-oxido-1-phenyl-1-pyridin-2-ylmethanimine)
CID 50910437

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dibromo-1-phenylethenyl)pyridine?
The IUPAC name of 2-(2,2-dibromo-1-phenylethenyl)pyridine (CID 139230167) is 2-(2,2-dibromo-1-phenylethenyl)pyridine.
What is the SMILES notation for 2-(2,2-dibromo-1-phenylethenyl)pyridine?
The canonical SMILES for 2-(2,2-dibromo-1-phenylethenyl)pyridine is BrC(Br)=C(c1ccccc1)c1ccccn1.
What is the InChIKey of 2-(2,2-dibromo-1-phenylethenyl)pyridine?
The InChIKey is HCDWFXHNTIEDBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Br2N/c14-13(15)12(10-6-2-1-3-7-10)11-8-4-5-9-16-11/h1-9H.
What are the key properties of 2-(2,2-dibromo-1-phenylethenyl)pyridine?
2-(2,2-dibromo-1-phenylethenyl)pyridine has a molecular weight of 339.03 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dibromo-1-phenylethenyl)pyridine is sourced from PubChem (CID 139230167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).