5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine

C137H110N14 — CID 164976645

IUPAC5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine
SMILESCc1cc(-c2ccccc2)cc(-c2ccccc2)n1.Cc1cc(-c2ccccc2)nc(-c2ccccc2)c1.Cc1cc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1nc(-c2cccc(-c3ccccc3)c2)nc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2ccccc2)cc(-c2ccccc2)n1.Cc1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ncc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cn1
InChIInChI=1S/C28H21N3.C23H18N2.2C18H15N.2C17H14N2.C16H13N3/c1-20-29-27(25-16-8-14-23(18-25)21-10-4-2-5-11-21)31-28(30-20)26-17-9-15-24(19-26)22-12-6-3-7-13-22;1-17-24-15-23(16-25-17)22-13-20(18-8-4-2-5-9-18)12-21(14-22)19-10-6-3-7-11-19;1-14-12-17(15-8-4-2-5-9-15)13-18(19-14)16-10-6-3-7-11-16;1-14-12-17(15-8-4-2-5-9-15)19-18(13-14)16-10-6-3-7-11-16;1-13-18-16(14-8-4-2-5-9-14)12-17(19-13)15-10-6-3-7-11-15;1-13-12-16(14-8-4-2-5-9-14)19-17(18-13)15-10-6-3-7-11-15;1-12-17-15(13-8-4-2-5-9-13)19-16(18-12)14-10-6-3-7-11-14/h2-19H,1H3;2-16H,1H3;2*2-13H,1H3;2*2-12H,1H3;2-11H,1H3
InChIKeyDWNZOGCADLMQLJ-UHFFFAOYSA-N
MW1952.48 g/mol
LogP33.83
Rot. Bonds17

About 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine

5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine (PubChem CID 164976645) has the molecular formula C137H110N14 and a molecular weight of 1952.48 g/mol. Its IUPAC name is 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine.

Molecular Properties

Compound Name5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine
PubChem CID164976645
Molecular FormulaC137H110N14
Molecular Weight1952.48 g/mol
Exact Mass1950.90
IUPAC Name5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine
SMILESCc1cc(-c2ccccc2)cc(-c2ccccc2)n1.Cc1cc(-c2ccccc2)nc(-c2ccccc2)c1.Cc1cc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1nc(-c2cccc(-c3ccccc3)c2)nc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2ccccc2)cc(-c2ccccc2)n1.Cc1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ncc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cn1
InChIInChI=1S/C28H21N3.C23H18N2.2C18H15N.2C17H14N2.C16H13N3/c1-20-29-27(25-16-8-14-23(18-25)21-10-4-2-5-11-21)31-28(30-20)26-17-9-15-24(19-26)22-12-6-3-7-13-22;1-17-24-15-23(16-25-17)22-13-20(18-8-4-2-5-9-18)12-21(14-22)19-10-6-3-7-11-19;1-14-12-17(15-8-4-2-5-9-15)13-18(19-14)16-10-6-3-7-11-16;1-14-12-17(15-8-4-2-5-9-15)19-18(13-14)16-10-6-3-7-11-16;1-13-18-16(14-8-4-2-5-9-14)12-17(19-13)15-10-6-3-7-11-15;1-13-12-16(14-8-4-2-5-9-14)19-17(18-13)15-10-6-3-7-11-15;1-12-17-15(13-8-4-2-5-9-13)19-16(18-12)14-10-6-3-7-11-14/h2-19H,1H3;2-16H,1H3;2*2-13H,1H3;2*2-12H,1H3;2-11H,1H3
InChIKeyDWNZOGCADLMQLJ-UHFFFAOYSA-N
XLogP33.83
TPSA180.46 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds17
Heavy Atoms151
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001952.48
LogP ≤ 533.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine?
The IUPAC name of 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine (CID 164976645) is 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine.
What is the SMILES notation for 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine?
The canonical SMILES for 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine is Cc1cc(-c2ccccc2)cc(-c2ccccc2)n1.Cc1cc(-c2ccccc2)nc(-c2ccccc2)c1.Cc1cc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1nc(-c2cccc(-c3ccccc3)c2)nc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2ccccc2)cc(-c2ccccc2)n1.Cc1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1ncc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cn1.
What is the InChIKey of 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine?
The InChIKey is DWNZOGCADLMQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N3.C23H18N2.2C18H15N.2C17H14N2.C16H13N3/c1-20-29-27(25-16-8-14-23(18-25)21-10-4-2-5-11-21)31-28(30-20)26-17-9-15-24(19-26)22-12-6-3-7-13-22;1-17-24-15-23(16-25-17)22-13-20(18-8-4-2-5-9-18)12-21(14-22)19-10-6-3-7-11-19;1-14-12-17(15-8-4-2-5-9-15)13-18(19-14)16-10-6-3-7-11-16;1-14-12-17(15-8-4-2-5-9-15)19-18(13-14)16-10-6-3-7-11-16;1-13-18-16(14-8-4-2-5-9-14)12-17(19-13)15-10-6-3-7-11-15;1-13-12-16(14-8-4-2-5-9-14)19-17(18-13)15-10-6-3-7-11-15;1-12-17-15(13-8-4-2-5-9-13)19-16(18-12)14-10-6-3-7-11-14/h2-19H,1H3;2-16H,1H3;2*2-13H,1H3;2*2-12H,1H3;2-11H,1H3.
What are the key properties of 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine?
5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine has a molecular weight of 1952.48 g/mol, XLogP of 33.83, 17 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-diphenylphenyl)-2-methylpyrimidine;2-methyl-4,6-bis(3-phenylphenyl)-1,3,5-triazine;2-methyl-4,6-diphenylpyridine;4-methyl-2,6-diphenylpyridine;2-methyl-4,6-diphenylpyrimidine;4-methyl-2,6-diphenylpyrimidine;2-methyl-4,6-diphenyl-1,3,5-triazine is sourced from PubChem (CID 164976645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).