2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine

C23H20N2 — CID 58461112

IUPAC2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine
SMILESCc1nc(C)c(-c2ccc(-c3cccc4ccccc34)cc2)nc1C
InChIInChI=1S/C23H20N2/c1-15-16(2)25-23(17(3)24-15)20-13-11-19(12-14-20)22-10-6-8-18-7-4-5-9-21(18)22/h4-14H,1-3H3
InChIKeyIFEPISCWZWQJTE-UHFFFAOYSA-N
MW324.43 g/mol
LogP5.89
Rot. Bonds2

About 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine

2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine (PubChem CID 58461112) has the molecular formula C23H20N2 and a molecular weight of 324.43 g/mol. Its IUPAC name is 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine.

Molecular Properties

Compound Name2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine
PubChem CID58461112
Molecular FormulaC23H20N2
Molecular Weight324.43 g/mol
Exact Mass324.16
IUPAC Name2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine
SMILESCc1nc(C)c(-c2ccc(-c3cccc4ccccc34)cc2)nc1C
InChIInChI=1S/C23H20N2/c1-15-16(2)25-23(17(3)24-15)20-13-11-19(12-14-20)22-10-6-8-18-7-4-5-9-21(18)22/h4-14H,1-3H3
InChIKeyIFEPISCWZWQJTE-UHFFFAOYSA-N
XLogP5.89
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.43
LogP ≤ 55.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-dimethyl-3-(2-methylphenyl)-5-naphthalen-1-ylpyrazine
CID 145390440
iridium;pentane-2,4-diol;2,3,5-trimethyl-6-(4-naphthalen-1-ylbenzene-6-id-1-yl)pyrazine
CID 58461111
1-[4-(2,3-dimethylphenyl)phenyl]naphthalene
CID 171799142
1-(2-methyl-4-naphthalen-1-ylphenyl)naphthalene
CID 145377660
9-(4-naphthalen-1-ylphenyl)-10-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]anthracene
CID 59557524
9,10-dimethyl-3-naphthalen-1-ylphenanthrene
CID 158591349
1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707
ethane;1-(4-ethylphenyl)naphthalene
CID 143262541
2-methyl-4-naphthalen-1-ylaniline
CID 54912725
2-methyl-6-naphthalen-1-ylquinoline
CID 58099181
2-methyl-4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130260993
1-(3-methyl-5-naphthalen-1-ylphenyl)naphthalene
CID 59171646

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine?
The IUPAC name of 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine (CID 58461112) is 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine.
What is the SMILES notation for 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine?
The canonical SMILES for 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine is Cc1nc(C)c(-c2ccc(-c3cccc4ccccc34)cc2)nc1C.
What is the InChIKey of 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine?
The InChIKey is IFEPISCWZWQJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2/c1-15-16(2)25-23(17(3)24-15)20-13-11-19(12-14-20)22-10-6-8-18-7-4-5-9-21(18)22/h4-14H,1-3H3.
What are the key properties of 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine?
2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine has a molecular weight of 324.43 g/mol, XLogP of 5.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine is sourced from PubChem (CID 58461112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).