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

C38H65N3 — CID 164992574

IUPACmethane;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
SMILESC.C.Cc1nc(C(C)C)c(C)c(C)c1C.Cc1nc(C)c(C(C)C)c(C)c1C.Cc1nc(C)c(C)c(C(C)C)c1C
InChIInChI=1S/3C12H19N.2CH4/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;1-7(2)12-10(5)8(3)9(4)11(6)13-12;;/h3*7H,1-6H3;2*1H4
InChIKeyHBLMYMJSRANYLL-UHFFFAOYSA-N
MW563.96 g/mol
LogP11.59
Rot. Bonds3

About 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

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 (PubChem CID 164992574) has the molecular formula C38H65N3 and a molecular weight of 563.96 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Namemethane;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
PubChem CID164992574
Molecular FormulaC38H65N3
Molecular Weight563.96 g/mol
Exact Mass563.52
IUPAC Namemethane;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
SMILESC.C.Cc1nc(C(C)C)c(C)c(C)c1C.Cc1nc(C)c(C(C)C)c(C)c1C.Cc1nc(C)c(C)c(C(C)C)c1C
InChIInChI=1S/3C12H19N.2CH4/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;1-7(2)12-10(5)8(3)9(4)11(6)13-12;;/h3*7H,1-6H3;2*1H4
InChIKeyHBLMYMJSRANYLL-UHFFFAOYSA-N
XLogP11.59
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.96
LogP ≤ 511.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 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 with MolForge

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Related Compounds

2,5-dimethyl-3,6-di(propan-2-yl)pyrazine;1,2,4,5-tetramethyl-3,6-di(propan-2-yl)benzene;bis(2,4,5-trimethyl-3,6-di(propan-2-yl)pyridine);tetrakis(yttrium)
CID 161444626
2,3,5-trimethyl-4,6-di(propan-2-yl)pyridine
CID 58935885
2,3,4,5-tetramethyl-6-propan-2-ylpyridine
CID 21340844
2,6-dimethyl-3,5-di(propan-2-yl)pyrazine;4,5-dimethyl-2,6-di(propan-2-yl)pyrimidine;1,2,3,5-tetramethyl-4,6-di(propan-2-yl)benzene;bis(2,3,5-trimethyl-4,6-di(propan-2-yl)pyridine);2,4,6-trimethyl-3,5-di(propan-2-yl)pyridine;3,4,5-trimethyl-2,6-di(propan-2-yl)pyridine
CID 164995532
2,4-dimethyl-3,5,6-tri(propan-2-yl)pyridine
CID 58164622
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-pentamethyl-6-propan-2-ylbenzene
CID 13359400
4,5-dimethyl-3-propan-2-yl-1,2-oxazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;1,2,3,4,5-pentamethyl-6-propan-2-ylbenzene;4,5,6,7-tetramethyl-2-propan-2-yl-1,3-benzothiazole;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;4,5,6-trimethyl-2-propan-2-ylpyrimidine
CID 157338189
2,3,4,5-tetramethyl-6-propan-2-ylpyridine;2,3,5-trimethyl-6-propan-2-ylpyrazine;3,4,5-trimethyl-6-propan-2-ylpyridazine;2,4,5-trimethyl-6-propan-2-ylpyrimidine
CID 159133858
2,3,4,5,6,7-hexamethyl-8-propan-2-ylquinoline
CID 157183613
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
2,3,5,6,7-pentamethyl-8-propan-2-ylquinoxaline
CID 157183608

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is C.C.Cc1nc(C(C)C)c(C)c(C)c1C.Cc1nc(C)c(C(C)C)c(C)c1C.Cc1nc(C)c(C)c(C(C)C)c1C.
What is the InChIKey of 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?
The InChIKey is HBLMYMJSRANYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H19N.2CH4/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;1-7(2)12-10(5)8(3)9(4)11(6)13-12;;/h3*7H,1-6H3;2*1H4.
What are the key properties of 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?
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 has a molecular weight of 563.96 g/mol, XLogP of 11.59, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 164992574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).