4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine

C105H76N6 — CID 161366762

IUPAC4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
SMILESCc1nc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)n1.Cc1nc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3cccc4ccccc34)cc2)n1
InChIInChI=1S/C39H28N2.2C33H24N2/c1-27-40-38(32-21-19-31(20-22-32)37-18-10-16-30-15-8-9-17-36(30)37)26-39(41-27)35-24-33(28-11-4-2-5-12-28)23-34(25-35)29-13-6-3-7-14-29;1-23-34-32(22-33(35-23)29-14-7-13-28(21-29)24-9-3-2-4-10-24)27-19-17-26(18-20-27)31-16-8-12-25-11-5-6-15-30(25)31;1-23-34-32(28-18-14-25(15-19-28)24-8-3-2-4-9-24)22-33(35-23)29-20-16-27(17-21-29)31-13-7-11-26-10-5-6-12-30(26)31/h2-26H,1H3;2*2-22H,1H3
InChIKeyVPXMSTGKHUUERZ-UHFFFAOYSA-N
MW1421.80 g/mol
LogP27.49
Rot. Bonds13

About 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine

4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine (PubChem CID 161366762) has the molecular formula C105H76N6 and a molecular weight of 1421.80 g/mol. Its IUPAC name is 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

Compound Name4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
PubChem CID161366762
Molecular FormulaC105H76N6
Molecular Weight1421.80 g/mol
Exact Mass1420.61
IUPAC Name4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
SMILESCc1nc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)n1.Cc1nc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3cccc4ccccc34)cc2)n1
InChIInChI=1S/C39H28N2.2C33H24N2/c1-27-40-38(32-21-19-31(20-22-32)37-18-10-16-30-15-8-9-17-36(30)37)26-39(41-27)35-24-33(28-11-4-2-5-12-28)23-34(25-35)29-13-6-3-7-14-29;1-23-34-32(22-33(35-23)29-14-7-13-28(21-29)24-9-3-2-4-10-24)27-19-17-26(18-20-27)31-16-8-12-25-11-5-6-15-30(25)31;1-23-34-32(28-18-14-25(15-19-28)24-8-3-2-4-9-24)22-33(35-23)29-20-16-27(17-21-29)31-13-7-11-26-10-5-6-12-30(26)31/h2-26H,1H3;2*2-22H,1H3
InChIKeyVPXMSTGKHUUERZ-UHFFFAOYSA-N
XLogP27.49
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms111
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001421.80
LogP ≤ 527.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine with MolForge

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Related Compounds

2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130260993
2,6-bis(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)phenyl]pyridine
CID 118901430
2-naphthalen-1-yl-4-(3-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130465785
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 155603318
2-(6-naphthalen-1-ylnaphthalen-2-yl)-4-(5-phenylnaphthalen-1-yl)-6-(3-phenylphenyl)pyrimidine
CID 177076865
4,6-dimethyl-2-[3-[2-(4-naphthalen-1-ylphenyl)-6-phenylpyrimidin-4-yl]phenyl]pyrimidine
CID 166057473
8-[4-[2-methyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]quinoline
CID 155603380
1-(3,5-diphenylphenyl)-3-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]isoquinoline;3-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-1-(3-naphthalen-1-ylphenyl)isoquinoline;3-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-1-(3-phenylphenyl)isoquinoline
CID 157287615
1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707
4-naphthalen-1-yl-6-(4-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)pyrimidine
CID 159653771
2-[3-[3,5-bis(3-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3,5-bis(4-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[3-[3-(3-phenylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[3-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine;2-[3-[3-(3-naphthalen-1-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-(4-naphthalen-1-ylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-(4-naphthalen-1-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 161312431
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-pyridin-2-ylpyrimidine
CID 130261239

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
The IUPAC name of 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine (CID 161366762) is 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine.
What is the SMILES notation for 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
The canonical SMILES for 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine is Cc1nc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)n1.Cc1nc(-c2ccc(-c3cccc4ccccc34)cc2)cc(-c2cccc(-c3ccccc3)c2)n1.Cc1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3cccc4ccccc34)cc2)n1.
What is the InChIKey of 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
The InChIKey is VPXMSTGKHUUERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H28N2.2C33H24N2/c1-27-40-38(32-21-19-31(20-22-32)37-18-10-16-30-15-8-9-17-36(30)37)26-39(41-27)35-24-33(28-11-4-2-5-12-28)23-34(25-35)29-13-6-3-7-14-29;1-23-34-32(22-33(35-23)29-14-7-13-28(21-29)24-9-3-2-4-10-24)27-19-17-26(18-20-27)31-16-8-12-25-11-5-6-15-30(25)31;1-23-34-32(28-18-14-25(15-19-28)24-8-3-2-4-9-24)22-33(35-23)29-20-16-27(17-21-29)31-13-7-11-26-10-5-6-12-30(26)31/h2-26H,1H3;2*2-22H,1H3.
What are the key properties of 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine has a molecular weight of 1421.80 g/mol, XLogP of 27.49, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-diphenylphenyl)-2-methyl-6-(4-naphthalen-1-ylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)pyrimidine;2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine is sourced from PubChem (CID 161366762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).