copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide

C14H12Br2CuN2 — CID 68902117

IUPACcopper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide
SMILESCc1cc(-c2ccccc2)nc(C)c1C#N.[Br-].[Br-].[Cu+2]
InChIInChI=1S/C14H12N2.2BrH.Cu/c1-10-8-14(12-6-4-3-5-7-12)16-11(2)13(10)9-15;;;/h3-8H,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyYEBJJYSSJLBGBV-UHFFFAOYSA-L
MW431.62 g/mol
LogP-2.76
Rot. Bonds1

About copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide

copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide (PubChem CID 68902117) has the molecular formula C14H12Br2CuN2 and a molecular weight of 431.62 g/mol. Its IUPAC name is copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide.

Molecular Properties

Compound Namecopper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide
PubChem CID68902117
Molecular FormulaC14H12Br2CuN2
Molecular Weight431.62 g/mol
Exact Mass428.87
IUPAC Namecopper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide
SMILESCc1cc(-c2ccccc2)nc(C)c1C#N.[Br-].[Br-].[Cu+2]
InChIInChI=1S/C14H12N2.2BrH.Cu/c1-10-8-14(12-6-4-3-5-7-12)16-11(2)13(10)9-15;;;/h3-8H,1-2H3;2*1H;/q;;;+2/p-2
InChIKeyYEBJJYSSJLBGBV-UHFFFAOYSA-L
XLogP-2.76
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.62
LogP ≤ 5-2.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4,6-diphenylpyridine-3-carbonitrile
CID 4135564
2-ethylsulfanyl-4-methyl-6-phenylpyridine-3-carbonitrile
CID 4083056
6-(4-methylphenyl)-2,4-diphenylpyridine-3-carbonitrile
CID 12575122
5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile
CID 71323044
2-(2-methylanilino)-4,6-diphenylpyridine-3-carbonitrile
CID 35214913
2-amino-4-(2,5-dimethylphenyl)-6-phenylpyridine-3-carbonitrile
CID 3351973
7-amino-5-chloro-4-methyl-2-phenyl-1,6-naphthyridine-8-carbonitrile
CID 100988453
2-ethyl-4,6-diphenylpyridine-3-carbonitrile
CID 102404081
2-(diethylamino)-4,6-diphenylpyridine-3-carbonitrile
CID 44522390
6-iodo-2,4-dimethylpyridine-3-carbonitrile
CID 89146475
2-amino-4-(4-tert-butylphenyl)-6-phenylpyridine-3-carbonitrile
CID 3350002
4,6-bis[4-(dimethylamino)phenyl]-2-methylpyridine-3-carbonitrile
CID 15133245

Frequently Asked Questions

What is the IUPAC name of copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide?
The IUPAC name of copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide (CID 68902117) is copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide.
What is the SMILES notation for copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide?
The canonical SMILES for copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide is Cc1cc(-c2ccccc2)nc(C)c1C#N.[Br-].[Br-].[Cu+2].
What is the InChIKey of copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide?
The InChIKey is YEBJJYSSJLBGBV-UHFFFAOYSA-L. The full InChI is InChI=1S/C14H12N2.2BrH.Cu/c1-10-8-14(12-6-4-3-5-7-12)16-11(2)13(10)9-15;;;/h3-8H,1-2H3;2*1H;/q;;;+2/p-2.
What are the key properties of copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide?
copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide has a molecular weight of 431.62 g/mol, XLogP of -2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide is sourced from PubChem (CID 68902117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).