2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine

C74H117N13 — CID 161466104

IUPAC2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine
SMILESCC(C)C.Cc1[nH]nc2ccccc12.Cc1nc(C(C)C)nc(C)c1C.Cc1nc(C)c(C(C)C)c(C)c1C.Cc1nc(C)c(C(C)C)c(C)n1.Cc1nc(C)c(C)c(C(C)C)c1C.Cc1nc(C)c(C)c(C(C)C)n1.Cc1nc(C)nc(C(C)C)n1
InChIInChI=1S/2C12H19N.3C10H16N2.C8H13N3.C8H8N2.C4H10/c1-7(2)12-8(3)10(5)13-11(6)9(12)4;1-7(2)12-9(4)8(3)10(5)13-11(12)6;1-6(2)10-7(3)11-9(5)12-8(10)4;1-6(2)10-7(3)8(4)11-9(5)12-10;1-6(2)10-11-8(4)7(3)9(5)12-10;1-5(2)8-10-6(3)9-7(4)11-8;1-6-7-4-2-3-5-8(7)10-9-6;1-4(2)3/h2*7H,1-6H3;3*6H,1-5H3;5H,1-4H3;2-5H,1H3,(H,9,10);4H,1-3H3
InChIKeyWCLMFSYEWKHOAS-UHFFFAOYSA-N
MW1188.84 g/mol
LogP19.60
Rot. Bonds6

About 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine

2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine (PubChem CID 161466104) has the molecular formula C74H117N13 and a molecular weight of 1188.84 g/mol. Its IUPAC name is 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine.

Molecular Properties

Compound Name2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine
PubChem CID161466104
Molecular FormulaC74H117N13
Molecular Weight1188.84 g/mol
Exact Mass1187.96
IUPAC Name2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine
SMILESCC(C)C.Cc1[nH]nc2ccccc12.Cc1nc(C(C)C)nc(C)c1C.Cc1nc(C)c(C(C)C)c(C)c1C.Cc1nc(C)c(C(C)C)c(C)n1.Cc1nc(C)c(C)c(C(C)C)c1C.Cc1nc(C)c(C)c(C(C)C)n1.Cc1nc(C)nc(C(C)C)n1
InChIInChI=1S/2C12H19N.3C10H16N2.C8H13N3.C8H8N2.C4H10/c1-7(2)12-8(3)10(5)13-11(6)9(12)4;1-7(2)12-9(4)8(3)10(5)13-11(12)6;1-6(2)10-7(3)11-9(5)12-8(10)4;1-6(2)10-7(3)8(4)11-9(5)12-10;1-6(2)10-11-8(4)7(3)9(5)12-10;1-5(2)8-10-6(3)9-7(4)11-8;1-6-7-4-2-3-5-8(7)10-9-6;1-4(2)3/h2*7H,1-6H3;3*6H,1-5H3;5H,1-4H3;2-5H,1H3,(H,9,10);4H,1-3H3
InChIKeyWCLMFSYEWKHOAS-UHFFFAOYSA-N
XLogP19.60
TPSA170.47 Ų
H-Bond Donors1
H-Bond Acceptors12
Rotatable Bonds6
Heavy Atoms87
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001188.84
LogP ≤ 519.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1012

Analyze 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine?
The IUPAC name of 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine (CID 161466104) is 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine.
What is the SMILES notation for 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine?
The canonical SMILES for 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine is CC(C)C.Cc1[nH]nc2ccccc12.Cc1nc(C(C)C)nc(C)c1C.Cc1nc(C)c(C(C)C)c(C)c1C.Cc1nc(C)c(C(C)C)c(C)n1.Cc1nc(C)c(C)c(C(C)C)c1C.Cc1nc(C)c(C)c(C(C)C)n1.Cc1nc(C)nc(C(C)C)n1.
What is the InChIKey of 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine?
The InChIKey is WCLMFSYEWKHOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H19N.3C10H16N2.C8H13N3.C8H8N2.C4H10/c1-7(2)12-8(3)10(5)13-11(6)9(12)4;1-7(2)12-9(4)8(3)10(5)13-11(12)6;1-6(2)10-7(3)11-9(5)12-8(10)4;1-6(2)10-7(3)8(4)11-9(5)12-10;1-6(2)10-11-8(4)7(3)9(5)12-10;1-5(2)8-10-6(3)9-7(4)11-8;1-6-7-4-2-3-5-8(7)10-9-6;1-4(2)3/h2*7H,1-6H3;3*6H,1-5H3;5H,1-4H3;2-5H,1H3,(H,9,10);4H,1-3H3.
What are the key properties of 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine?
2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine has a molecular weight of 1188.84 g/mol, XLogP of 19.60, 6 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6-propan-2-yl-1,3,5-triazine;3-methyl-2H-indazole;2-methylpropane;2,3,4,6-tetramethyl-5-propan-2-ylpyridine;2,3,5,6-tetramethyl-4-propan-2-ylpyridine;2,4,5-trimethyl-6-propan-2-ylpyrimidine;2,4,6-trimethyl-5-propan-2-ylpyrimidine;4,5,6-trimethyl-2-propan-2-ylpyrimidine is sourced from PubChem (CID 161466104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).