2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine

C33H24N2 — CID 130260993

IUPAC2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3cccc4ccccc34)cc2)n1
InChIInChI=1S/C33H24N2/c1-23-34-32(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/h2-22H,1H3
InChIKeyPMGZMXOUCMRDMF-UHFFFAOYSA-N
MW448.57 g/mol
LogP8.61
Rot. Bonds4

About 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine

2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine (PubChem CID 130260993) has the molecular formula C33H24N2 and a molecular weight of 448.57 g/mol. Its IUPAC name is 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine.

Molecular Properties

Compound Name2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
PubChem CID130260993
Molecular FormulaC33H24N2
Molecular Weight448.57 g/mol
Exact Mass448.19
IUPAC Name2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3cccc4ccccc34)cc2)n1
InChIInChI=1S/C33H24N2/c1-23-34-32(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/h2-22H,1H3
InChIKeyPMGZMXOUCMRDMF-UHFFFAOYSA-N
XLogP8.61
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.57
LogP ≤ 58.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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
4-naphthalen-1-yl-6-(4-naphthalen-1-ylphenyl)-2-(4-phenylphenyl)pyrimidine
CID 159653771
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-pyridin-2-ylpyrimidine
CID 130261239
2-naphthalen-1-yl-4,6-bis(4-naphthalen-1-ylphenyl)pyrimidine
CID 129265535
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
4,6-dimethyl-2-[3-[2-(4-naphthalen-1-ylphenyl)-6-phenylpyrimidin-4-yl]phenyl]pyrimidine
CID 166057473
2-methyl-4-naphthalen-1-yl-6-naphthalen-2-ylpyrimidine
CID 118148910
2-[4-[2-(4-naphthalen-1-ylphenyl)propan-2-yl]phenyl]-4,6-diphenylpyridine
CID 121315369
4-(4-dibenzofuran-1-ylphenyl)-2-methyl-6-phenylpyrimidine
CID 149347803
4-(4-naphthalen-1-ylphenyl)-6-(7-phenylphenanthren-2-yl)-2-(4-phenylphenyl)pyrimidine
CID 168844850
2-[4-[5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenylpyridine
CID 118075155

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
The IUPAC name of 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine (CID 130260993) is 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine.
What is the SMILES notation for 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
The canonical SMILES for 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine is Cc1nc(-c2ccc(-c3ccccc3)cc2)cc(-c2ccc(-c3cccc4ccccc34)cc2)n1.
What is the InChIKey of 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
The InChIKey is PMGZMXOUCMRDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H24N2/c1-23-34-32(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/h2-22H,1H3.
What are the key properties of 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine?
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine has a molecular weight of 448.57 g/mol, XLogP of 8.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine is sourced from PubChem (CID 130260993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).