1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine

C26H36N2 — CID 91135840

IUPAC1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine
SMILESCc1c(C)c(C)c2c(C)c(C)c(C)c(C)c2c1C.Cc1nc(C)c(C)c(C)n1
InChIInChI=1S/C18H24.C8H12N2/c1-9-10(2)14(6)18-16(8)12(4)11(3)15(7)17(18)13(9)5;1-5-6(2)9-8(4)10-7(5)3/h1-8H3;1-4H3
InChIKeyGWLYZTDIIZLIEW-UHFFFAOYSA-N
MW376.59 g/mol
LogP7.02
Rot. Bonds

About 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine

1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine (PubChem CID 91135840) has the molecular formula C26H36N2 and a molecular weight of 376.59 g/mol. Its IUPAC name is 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine.

Molecular Properties

Compound Name1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine
PubChem CID91135840
Molecular FormulaC26H36N2
Molecular Weight376.59 g/mol
Exact Mass376.29
IUPAC Name1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine
SMILESCc1c(C)c(C)c2c(C)c(C)c(C)c(C)c2c1C.Cc1nc(C)c(C)c(C)n1
InChIInChI=1S/C18H24.C8H12N2/c1-9-10(2)14(6)18-16(8)12(4)11(3)15(7)17(18)13(9)5;1-5-6(2)9-8(4)10-7(5)3/h1-8H3;1-4H3
InChIKeyGWLYZTDIIZLIEW-UHFFFAOYSA-N
XLogP7.02
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.59
LogP ≤ 57.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tris(2,3,4,5,6-pentamethylpyridine);tris(2,4,5,6-tetramethylpyrimidine)
CID 157180275
1,2,3,4,5,6-hexamethylbenzene;methane;bis(1,2,3,4,5,6,7,8-octamethylnaphthalene);1,2,3,4,5-pentamethyl-6-(2,3,4,5,6-pentamethylphenyl)benzene;tris(2,3,4,5,6-pentamethylpyridine);2,3,4,6-tetramethyl-5-(2,3,4,5,6-pentamethylphenyl)pyridine;bis(2,4,5,6-tetramethylpyrimidine)
CID 158125527
tris(2,3,4,5,6-pentamethylpyridine);2,3,5,6-tetramethylpyrazine;tris(2,4,5,6-tetramethylpyrimidine)
CID 159315646
1,2,3,4,5,6-hexamethylbenzene;bis(2,3,4,5,6-pentamethylpyridine);2,3,5,6-tetramethylpyrazine;bis(3,4,5,6-tetramethylpyridazine);2,4,5,6-tetramethylpyrimidine
CID 161209554
tetrakis(2,4,5,6,7,8-hexamethylquinazoline);2,4,6-trimethyl-1,3,5-triazine
CID 159228975
hexakis(2,4,5,6,7,8-hexamethylquinazoline);2,4,6-trimethyl-1,3,5-triazine
CID 159474049
tris(2,3,4,5,6-pentamethylpyridine);2,3,5,6-tetramethylpyrazine;3,4,5,6-tetramethylpyridazine;tris(2,4,5,6-tetramethylpyrimidine);bis(2,3,4,5-tetramethylthiophene)
CID 162065658
2,3,4,5,6,7-hexamethyl-1,8-naphthyridine
CID 54476494
4-ethenyl-2,5,6-trimethylpyrimidine
CID 145409646
2-chloro-4,5,6-trimethylpyrimidine
CID 12501987
5-iodo-2,4,6-trimethylpyrimidine
CID 10911871
2-(2,5,6-trimethylpyrimidin-4-yl)propan-2-amine
CID 96852081

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine?
The IUPAC name of 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine (CID 91135840) is 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine.
What is the SMILES notation for 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine?
The canonical SMILES for 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine is Cc1c(C)c(C)c2c(C)c(C)c(C)c(C)c2c1C.Cc1nc(C)c(C)c(C)n1.
What is the InChIKey of 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine?
The InChIKey is GWLYZTDIIZLIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24.C8H12N2/c1-9-10(2)14(6)18-16(8)12(4)11(3)15(7)17(18)13(9)5;1-5-6(2)9-8(4)10-7(5)3/h1-8H3;1-4H3.
What are the key properties of 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine?
1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine has a molecular weight of 376.59 g/mol, XLogP of 7.02, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6,7,8-octamethylnaphthalene;2,4,5,6-tetramethylpyrimidine is sourced from PubChem (CID 91135840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).