4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

C120H89BrCl3F3N12O6 — CID 159739640

IUPAC4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
SMILESCc1cc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-c3cccc(O)c3)nc(C)c2C#N)ccc1Cl.Cc1ccc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)c(Cl)c1.Cc1cccc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)c1.Cc1cccc(-c2cc(-c3cccc(O)c3)nc(C)c2C#N)c1Cl.Cc1nc(-c2cccc(O)c2)cc(-c2cccc(Br)c2)c1C#N
InChIInChI=1S/C21H15F3N2O.3C20H15ClN2O.C20H16N2O.C19H13BrN2O/c1-12-7-15(9-16(8-12)21(22,23)24)18-10-20(26-13(2)19(18)11-25)14-3-5-17(27)6-4-14;1-12-3-8-16(19(21)9-12)17-10-20(23-13(2)18(17)11-22)14-4-6-15(24)7-5-14;1-12-5-3-8-16(20(12)21)17-10-19(23-13(2)18(17)11-22)14-6-4-7-15(24)9-14;1-12-8-14(6-7-19(12)21)17-10-20(23-13(2)18(17)11-22)15-4-3-5-16(24)9-15;1-13-4-3-5-16(10-13)18-11-20(22-14(2)19(18)12-21)15-6-8-17(23)9-7-15;1-12-18(11-21)17(13-4-2-6-15(20)8-13)10-19(22-12)14-5-3-7-16(23)9-14/h3-10,27H,1-2H3;3*3-10,24H,1-2H3;3-11,23H,1-2H3;2-10,23H,1H3
InChIKeyNCHAIIJDTDJIFD-UHFFFAOYSA-N
MW2038.37 g/mol
LogP31.09
Rot. Bonds12

About 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile (PubChem CID 159739640) has the molecular formula C120H89BrCl3F3N12O6 and a molecular weight of 2038.37 g/mol. Its IUPAC name is 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
PubChem CID159739640
Molecular FormulaC120H89BrCl3F3N12O6
Molecular Weight2038.37 g/mol
Exact Mass2034.52
IUPAC Name4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
SMILESCc1cc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-c3cccc(O)c3)nc(C)c2C#N)ccc1Cl.Cc1ccc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)c(Cl)c1.Cc1cccc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)c1.Cc1cccc(-c2cc(-c3cccc(O)c3)nc(C)c2C#N)c1Cl.Cc1nc(-c2cccc(O)c2)cc(-c2cccc(Br)c2)c1C#N
InChIInChI=1S/C21H15F3N2O.3C20H15ClN2O.C20H16N2O.C19H13BrN2O/c1-12-7-15(9-16(8-12)21(22,23)24)18-10-20(26-13(2)19(18)11-25)14-3-5-17(27)6-4-14;1-12-3-8-16(19(21)9-12)17-10-20(23-13(2)18(17)11-22)14-4-6-15(24)7-5-14;1-12-5-3-8-16(20(12)21)17-10-19(23-13(2)18(17)11-22)14-6-4-7-15(24)9-14;1-12-8-14(6-7-19(12)21)17-10-20(23-13(2)18(17)11-22)15-4-3-5-16(24)9-15;1-13-4-3-5-16(10-13)18-11-20(22-14(2)19(18)12-21)15-6-8-17(23)9-7-15;1-12-18(11-21)17(13-4-2-6-15(20)8-13)10-19(22-12)14-5-3-7-16(23)9-14/h3-10,27H,1-2H3;3*3-10,24H,1-2H3;3-11,23H,1-2H3;2-10,23H,1H3
InChIKeyNCHAIIJDTDJIFD-UHFFFAOYSA-N
XLogP31.09
TPSA341.46 Ų
H-Bond Donors6
H-Bond Acceptors18
Rotatable Bonds12
Heavy Atoms145
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002038.37
LogP ≤ 531.09
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1018

Analyze 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile with MolForge

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Related Compounds

4-(3-Bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 136651505
4-(2-Chloro-4-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(3-chlorophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2,6-dichloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(3-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(3-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile;methane
CID 159027986
4-(2-Chloro-4-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(3-chlorophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2,6-dichloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(3-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(3-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 160375237
4-(2-Chloro-4-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2,6-dichloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;bis(6-(3-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile);6-(3-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile;methane
CID 161809863
4-(2-Chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2,6-dichloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2,6-dichloro-3-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile
CID 159900912
4-(2-Chloro-3-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2,6-dichloro-3-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;bis(6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile)
CID 162257408

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
The IUPAC name of 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile (CID 159739640) is 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile.
What is the SMILES notation for 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
The canonical SMILES for 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile is Cc1cc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)cc(C(F)(F)F)c1.Cc1cc(-c2cc(-c3cccc(O)c3)nc(C)c2C#N)ccc1Cl.Cc1ccc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)c(Cl)c1.Cc1cccc(-c2cc(-c3ccc(O)cc3)nc(C)c2C#N)c1.Cc1cccc(-c2cc(-c3cccc(O)c3)nc(C)c2C#N)c1Cl.Cc1nc(-c2cccc(O)c2)cc(-c2cccc(Br)c2)c1C#N.
What is the InChIKey of 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
The InChIKey is NCHAIIJDTDJIFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F3N2O.3C20H15ClN2O.C20H16N2O.C19H13BrN2O/c1-12-7-15(9-16(8-12)21(22,23)24)18-10-20(26-13(2)19(18)11-25)14-3-5-17(27)6-4-14;1-12-3-8-16(19(21)9-12)17-10-20(23-13(2)18(17)11-22)14-4-6-15(24)7-5-14;1-12-5-3-8-16(20(12)21)17-10-19(23-13(2)18(17)11-22)14-6-4-7-15(24)9-14;1-12-8-14(6-7-19(12)21)17-10-20(23-13(2)18(17)11-22)15-4-3-5-16(24)9-15;1-13-4-3-5-16(10-13)18-11-20(22-14(2)19(18)12-21)15-6-8-17(23)9-7-15;1-12-18(11-21)17(13-4-2-6-15(20)8-13)10-19(22-12)14-5-3-7-16(23)9-14/h3-10,27H,1-2H3;3*3-10,24H,1-2H3;3-11,23H,1-2H3;2-10,23H,1H3.
What are the key properties of 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile has a molecular weight of 2038.37 g/mol, XLogP of 31.09, 12 rotatable bonds, 6 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromophenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(2-chloro-4-methylphenyl)-6-(4-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;4-(4-chloro-3-methylphenyl)-6-(3-hydroxyphenyl)-2-methylpyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-(3-methylphenyl)pyridine-3-carbonitrile;6-(4-hydroxyphenyl)-2-methyl-4-[3-methyl-5-(trifluoromethyl)phenyl]pyridine-3-carbonitrile is sourced from PubChem (CID 159739640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).