1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine

C132H182N24O4 — CID 162052041

IUPAC1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine
SMILESC.Cc1c(C)c(C(C)C)c2c(c(C)nc(=O)n2C)c1C.Cc1c(C)c(C(C)C)c2c(c1C)c(=O)n(C)c(=O)n2C.Cc1c(C)c(C(C)C)c2c(c1C)c(C)c(C)c(=O)n2C.Cc1nc(C(C)C)c2nc(C)c(C)c(C)c2n1.Cc1nc(C(C)C)c2nc(C)c(C)nc2n1.Cc1nc(C(C)C)c2nc(C)nc(C)c2n1.Cc1nc2c(C(C)C)c(C)nnc2c(C)c1C.Cc1nc2c(C(C)C)ncc(C)c2c(C)c1C.Cc1nc2nc(C)c(C)c(C(C)C)c2nc1C
InChIInChI=1S/C18H25NO.C16H22N2O2.C16H22N2O.C15H20N2.3C14H19N3.2C12H16N4.CH4/c1-9(2)15-11(4)10(3)12(5)16-13(6)14(7)18(20)19(8)17(15)16;1-8(2)12-10(4)9(3)11(5)13-14(12)17(6)16(20)18(7)15(13)19;1-8(2)13-10(4)9(3)11(5)14-12(6)17-16(19)18(7)15(13)14;1-8(2)14-15-13(9(3)7-16-14)11(5)10(4)12(6)17-15;1-7(2)12-8(3)9(4)16-14-13(12)15-10(5)11(6)17-14;1-7(2)12-14-13(17-11(6)16-12)9(4)8(3)10(5)15-14;1-7(2)12-11(6)16-17-13-9(4)8(3)10(5)15-14(12)13;1-6(2)10-12-11(15-9(5)14-10)7(3)13-8(4)16-12;1-6(2)10-11-12(16-9(5)15-10)14-8(4)7(3)13-11;/h9H,1-8H3;8H,1-7H3;8H,1-7H3;7-8H,1-6H3;3*7H,1-6H3;2*6H,1-5H3;1H4
InChIKeyYYRCLJDXAYHLGK-UHFFFAOYSA-N
MW2169.07 g/mol
LogP29.49
Rot. Bonds9

About 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine

1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine (PubChem CID 162052041) has the molecular formula C132H182N24O4 and a molecular weight of 2169.07 g/mol. Its IUPAC name is 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine.

Molecular Properties

Compound Name1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine
PubChem CID162052041
Molecular FormulaC132H182N24O4
Molecular Weight2169.07 g/mol
Exact Mass2167.48
IUPAC Name1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine
SMILESC.Cc1c(C)c(C(C)C)c2c(c(C)nc(=O)n2C)c1C.Cc1c(C)c(C(C)C)c2c(c1C)c(=O)n(C)c(=O)n2C.Cc1c(C)c(C(C)C)c2c(c1C)c(C)c(C)c(=O)n2C.Cc1nc(C(C)C)c2nc(C)c(C)c(C)c2n1.Cc1nc(C(C)C)c2nc(C)c(C)nc2n1.Cc1nc(C(C)C)c2nc(C)nc(C)c2n1.Cc1nc2c(C(C)C)c(C)nnc2c(C)c1C.Cc1nc2c(C(C)C)ncc(C)c2c(C)c1C.Cc1nc2nc(C)c(C)c(C(C)C)c2nc1C
InChIInChI=1S/C18H25NO.C16H22N2O2.C16H22N2O.C15H20N2.3C14H19N3.2C12H16N4.CH4/c1-9(2)15-11(4)10(3)12(5)16-13(6)14(7)18(20)19(8)17(15)16;1-8(2)12-10(4)9(3)11(5)13-14(12)17(6)16(20)18(7)15(13)19;1-8(2)13-10(4)9(3)11(5)14-12(6)17-16(19)18(7)15(13)14;1-8(2)14-15-13(9(3)7-16-14)11(5)10(4)12(6)17-15;1-7(2)12-8(3)9(4)16-14-13(12)15-10(5)11(6)17-14;1-7(2)12-14-13(17-11(6)16-12)9(4)8(3)10(5)15-14;1-7(2)12-11(6)16-17-13-9(4)8(3)10(5)15-14(12)13;1-6(2)10-12-11(15-9(5)14-10)7(3)13-8(4)16-12;1-6(2)10-11-12(16-9(5)15-10)14-8(4)7(3)13-11;/h9H,1-8H3;8H,1-7H3;8H,1-7H3;7-8H,1-6H3;3*7H,1-6H3;2*6H,1-5H3;1H4
InChIKeyYYRCLJDXAYHLGK-UHFFFAOYSA-N
XLogP29.49
TPSA345.80 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds9
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002169.07
LogP ≤ 529.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine with MolForge

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Related Compounds

1,3,4,5,6,7-hexamethyl-8-propan-2-ylisoquinoline;3,4,5,6,7,8-hexamethyl-1-propan-2-ylisoquinoline;2,3,4,5,6,7-hexamethyl-8-propan-2-ylquinoline;3,4,5,6,7-pentamethyl-8-propan-2-ylcinnoline;2,3,4,5,6-pentamethyl-8-propan-2-yl-1,7-naphthyridine;2,3,4,5,7-pentamethyl-8-propan-2-yl-1,6-naphthyridine;2,3,4,6,7-pentamethyl-8-propan-2-yl-1,5-naphthyridine;2,4,5,6,7-pentamethyl-8-propan-2-ylquinazoline;2,3,5,6,7-pentamethyl-8-propan-2-ylquinoxaline;2,3,5,7-tetramethyl-8-propan-2-ylpyrido[3,4-b]pyrazine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;2,3,7,8-tetramethyl-5-propan-2-ylpyrido[3,4-b]pyrazine;2,4,5,6-tetramethyl-8-propan-2-ylpyrido[3,4-d]pyrimidine;2,4,5,7-tetramethyl-8-propan-2-ylpyrido[4,3-d]pyrimidine;2,4,6,7-tetramethyl-8-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine
CID 167690633
2,3,5,6,7-pentamethyl-8-propan-2-ylquinoxaline
CID 157183608
bis(2,3,4,5,6,7,8-heptamethylquinoline);3,4,5,6,7,8-hexamethylcinnoline;2,3,4,5,6,7-hexamethyl-1,8-naphthyridine;1,2,3,4,5,6-hexamethylpyrrolo[2,3-b]pyridine;2,4,5,6,7,8-hexamethylquinazoline;2,3,5,6,7,8-hexamethylquinoxaline;1,2,3,4,5,6,7,8-octamethylnaphthalene
CID 161268994
2,3,4,5,6,7-hexamethyl-8-propan-2-ylquinoline
CID 157183613
2,5-dimethyl-4-propan-2-ylpyrimidine
CID 58806234
methane;2,3,4,5-tetramethyl-6-propan-2-ylpyridine;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine
CID 164992574
2,7,8-trimethyl-4,5-di(propan-2-yl)quinazoline
CID 170416126
3,5-dimethyl-4,6-di(propan-2-yl)pyridazine;1,2,3,5-tetramethyl-4,6-di(propan-2-yl)benzene
CID 159916628
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
7-(difluoromethyl)-1,3,5-trimethylpyrido[4,3-d]pyrimidine-2,4-dione;ethane
CID 177215888
iron;1,3,7-trimethylpurine-2,6-dione
CID 158445461
3,6,7-trimethyl-2-methylsulfanylpteridin-4-one
CID 822190

Frequently Asked Questions

What is the IUPAC name of 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine?
The IUPAC name of 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine (CID 162052041) is 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine.
What is the SMILES notation for 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine?
The canonical SMILES for 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine is C.Cc1c(C)c(C(C)C)c2c(c(C)nc(=O)n2C)c1C.Cc1c(C)c(C(C)C)c2c(c1C)c(=O)n(C)c(=O)n2C.Cc1c(C)c(C(C)C)c2c(c1C)c(C)c(C)c(=O)n2C.Cc1nc(C(C)C)c2nc(C)c(C)c(C)c2n1.Cc1nc(C(C)C)c2nc(C)c(C)nc2n1.Cc1nc(C(C)C)c2nc(C)nc(C)c2n1.Cc1nc2c(C(C)C)c(C)nnc2c(C)c1C.Cc1nc2c(C(C)C)ncc(C)c2c(C)c1C.Cc1nc2nc(C)c(C)c(C(C)C)c2nc1C.
What is the InChIKey of 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine?
The InChIKey is YYRCLJDXAYHLGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO.C16H22N2O2.C16H22N2O.C15H20N2.3C14H19N3.2C12H16N4.CH4/c1-9(2)15-11(4)10(3)12(5)16-13(6)14(7)18(20)19(8)17(15)16;1-8(2)12-10(4)9(3)11(5)13-14(12)17(6)16(20)18(7)15(13)19;1-8(2)13-10(4)9(3)11(5)14-12(6)17-16(19)18(7)15(13)14;1-8(2)14-15-13(9(3)7-16-14)11(5)10(4)12(6)17-15;1-7(2)12-8(3)9(4)16-14-13(12)15-10(5)11(6)17-14;1-7(2)12-14-13(17-11(6)16-12)9(4)8(3)10(5)15-14;1-7(2)12-11(6)16-17-13-9(4)8(3)10(5)15-14(12)13;1-6(2)10-12-11(15-9(5)14-10)7(3)13-8(4)16-12;1-6(2)10-11-12(16-9(5)15-10)14-8(4)7(3)13-11;/h9H,1-8H3;8H,1-7H3;8H,1-7H3;7-8H,1-6H3;3*7H,1-6H3;2*6H,1-5H3;1H4.
What are the key properties of 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine?
1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine has a molecular weight of 2169.07 g/mol, XLogP of 29.49, 9 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4,5,6,7-hexamethyl-8-propan-2-ylquinolin-2-one;methane;1,3,5,6,7-pentamethyl-8-propan-2-ylquinazoline-2,4-dione;1,4,5,6,7-pentamethyl-8-propan-2-ylquinazolin-2-one;2,3,4,5-tetramethyl-8-propan-2-yl-1,7-naphthyridine;2,3,6,7-tetramethyl-8-propan-2-ylpyrido[2,3-b]pyrazine;3,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-c]pyridazine;2,6,7,8-tetramethyl-4-propan-2-ylpyrido[3,2-d]pyrimidine;2,6,7-trimethyl-4-propan-2-ylpteridine;2,6,8-trimethyl-4-propan-2-ylpyrimido[5,4-d]pyrimidine is sourced from PubChem (CID 162052041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).