2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine

C142H242N18 — CID 157096341

IUPAC2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine
SMILESCC(C)(C)CCc1cc(C(C)(C)C)cnn1.CC(C)(C)CCc1cc(C(C)(C)C)ncn1.CC(C)(C)CCc1ccnc(C(C)(C)C)n1.CC(C)(C)CCc1cncc(C(C)(C)C)n1.CC(C)(C)CCc1cnnc(C(C)(C)C)c1.CC(C)(C)CCc1nccc(C(C)(C)C)n1.CC(C)(C)Cc1ccc(CC(C)(C)C)nc1.CC(C)(C)Cc1ccc(CC(C)(C)C)nc1.CC(C)(C)Cc1ccnc(CC(C)(C)C)n1.CC(C)(C)Cc1cncc(CC(C)(C)C)n1
InChIInChI=1S/2C15H25N.8C14H24N2/c2*1-14(2,3)9-12-7-8-13(16-11-12)10-15(4,5)6;1-13(2,3)7-11-9-15-10-12(16-11)8-14(4,5)6;1-13(2,3)9-7-12-15-10-8-11(16-12)14(4,5)6;1-13(2,3)9-7-11-8-10-15-12(16-11)14(4,5)6;1-13(2,3)8-7-12-9-11(10-15-16-12)14(4,5)6;1-13(2,3)9-11-7-8-15-12(16-11)10-14(4,5)6;1-13(2,3)8-7-11-9-15-10-12(16-11)14(4,5)6;1-13(2,3)8-7-11-9-12(14(4,5)6)16-10-15-11;1-13(2,3)8-7-11-9-12(14(4,5)6)16-15-10-11/h2*7-8,11H,9-10H2,1-6H3;9-10H,7-8H2,1-6H3;2*8,10H,7,9H2,1-6H3;9-10H,7-8H2,1-6H3;7-8H,9-10H2,1-6H3;3*9-10H,7-8H2,1-6H3
InChIKeyAFGGFJMABQRRRA-UHFFFAOYSA-N
MW2201.62 g/mol
LogP38.34
Rot. Bonds20

About 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine

2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine (PubChem CID 157096341) has the molecular formula C142H242N18 and a molecular weight of 2201.62 g/mol. Its IUPAC name is 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine.

Molecular Properties

Compound Name2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine
PubChem CID157096341
Molecular FormulaC142H242N18
Molecular Weight2201.62 g/mol
Exact Mass2199.95
IUPAC Name2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine
SMILESCC(C)(C)CCc1cc(C(C)(C)C)cnn1.CC(C)(C)CCc1cc(C(C)(C)C)ncn1.CC(C)(C)CCc1ccnc(C(C)(C)C)n1.CC(C)(C)CCc1cncc(C(C)(C)C)n1.CC(C)(C)CCc1cnnc(C(C)(C)C)c1.CC(C)(C)CCc1nccc(C(C)(C)C)n1.CC(C)(C)Cc1ccc(CC(C)(C)C)nc1.CC(C)(C)Cc1ccc(CC(C)(C)C)nc1.CC(C)(C)Cc1ccnc(CC(C)(C)C)n1.CC(C)(C)Cc1cncc(CC(C)(C)C)n1
InChIInChI=1S/2C15H25N.8C14H24N2/c2*1-14(2,3)9-12-7-8-13(16-11-12)10-15(4,5)6;1-13(2,3)7-11-9-15-10-12(16-11)8-14(4,5)6;1-13(2,3)9-7-12-15-10-8-11(16-12)14(4,5)6;1-13(2,3)9-7-11-8-10-15-12(16-11)14(4,5)6;1-13(2,3)8-7-12-9-11(10-15-16-12)14(4,5)6;1-13(2,3)9-11-7-8-15-12(16-11)10-14(4,5)6;1-13(2,3)8-7-11-9-15-10-12(16-11)14(4,5)6;1-13(2,3)8-7-11-9-12(14(4,5)6)16-10-15-11;1-13(2,3)8-7-11-9-12(14(4,5)6)16-15-10-11/h2*7-8,11H,9-10H2,1-6H3;9-10H,7-8H2,1-6H3;2*8,10H,7,9H2,1-6H3;9-10H,7-8H2,1-6H3;7-8H,9-10H2,1-6H3;3*9-10H,7-8H2,1-6H3
InChIKeyAFGGFJMABQRRRA-UHFFFAOYSA-N
XLogP38.34
TPSA232.02 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds20
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002201.62
LogP ≤ 538.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine with MolForge

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Related Compounds

4,6-ditert-butyl-3-methylpyridazine;bis(3,5-ditert-butylpyridazine);2,4-ditert-butylpyrimidine;4,6-ditert-butylpyrimidine
CID 164990705
2-[3,3-dimethyl-4-(4-methylpyrimidin-2-yl)butyl]-6-(2,2-dimethylpropyl)pyrazine
CID 126702707
[5-(3,3-dimethylbutyl)pyridazin-3-yl]methanamine
CID 142361247
2-tert-butyl-6-propan-2-ylpyrazine;3-tert-butyl-5-propan-2-ylpyridazine;5-tert-butyl-3-propan-2-ylpyridazine;2-tert-butyl-4-propan-2-ylpyridine;2-tert-butyl-6-propan-2-ylpyridine;3-tert-butyl-5-propan-2-ylpyridine;4-tert-butyl-2-propan-2-ylpyridine;2-tert-butyl-4-propan-2-ylpyrimidine;4-tert-butyl-2-propan-2-ylpyrimidine;4-tert-butyl-6-propan-2-ylpyrimidine;2-tert-butyl-4-propan-2-yl-1,3,5-triazine
CID 158122570
N-(4-tert-butylphenyl)-2,2-dimethylpropanamide;N-(5-tert-butyl-2-pyridinyl)-2,2-dimethylpropanamide;N-(6-tert-butyl-3-pyridinyl)-2,2-dimethylpropanamide;N-[4-(3,3-dimethylbutyl)phenyl]-2,2-dimethylpropanamide;N-[5-(3,3-dimethylbutyl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[6-(3,3-dimethylbutyl)-3-pyridinyl]-2,2-dimethylpropanamide;N-[4-(2,2-dimethylpropyl)phenyl]-2,2-dimethylpropanamide;N-[5-(2,2-dimethylpropyl)-2-pyridinyl]-2,2-dimethylpropanamide;N-[6-(2,2-dimethylpropyl)-3-pyridinyl]-2,2-dimethylpropanamide
CID 158155279
3-tert-butyl-5-(3,3-dimethylbutyl)pyridine
CID 139460121
4-(4-cyclopropyl-3,3-dimethylbutyl)-2-(2,2-dimethylpropyl)pyrimidine
CID 129212607
4-(bromomethyl)-2-tert-butylpyrimidine
CID 126973454
4-(2,2-dimethylpropyl)-2-(2-methyl-2-methylsulfanylpropyl)pyrimidine
CID 139483154
4-tert-butyl-2-(2-phenylethyl)pyrimidine
CID 58147148
3-(6-tert-butylpyrimidin-4-yl)propan-1-amine
CID 83847400
3-[2-(6-tert-butylpyrimidin-4-yl)ethyl]-6-(3-methyl-2-pyridinyl)quinoline
CID 67153979

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine?
The IUPAC name of 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine (CID 157096341) is 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine.
What is the SMILES notation for 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine?
The canonical SMILES for 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine is CC(C)(C)CCc1cc(C(C)(C)C)cnn1.CC(C)(C)CCc1cc(C(C)(C)C)ncn1.CC(C)(C)CCc1ccnc(C(C)(C)C)n1.CC(C)(C)CCc1cncc(C(C)(C)C)n1.CC(C)(C)CCc1cnnc(C(C)(C)C)c1.CC(C)(C)CCc1nccc(C(C)(C)C)n1.CC(C)(C)Cc1ccc(CC(C)(C)C)nc1.CC(C)(C)Cc1ccc(CC(C)(C)C)nc1.CC(C)(C)Cc1ccnc(CC(C)(C)C)n1.CC(C)(C)Cc1cncc(CC(C)(C)C)n1.
What is the InChIKey of 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine?
The InChIKey is AFGGFJMABQRRRA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H25N.8C14H24N2/c2*1-14(2,3)9-12-7-8-13(16-11-12)10-15(4,5)6;1-13(2,3)7-11-9-15-10-12(16-11)8-14(4,5)6;1-13(2,3)9-7-12-15-10-8-11(16-12)14(4,5)6;1-13(2,3)9-7-11-8-10-15-12(16-11)14(4,5)6;1-13(2,3)8-7-12-9-11(10-15-16-12)14(4,5)6;1-13(2,3)9-11-7-8-15-12(16-11)10-14(4,5)6;1-13(2,3)8-7-11-9-15-10-12(16-11)14(4,5)6;1-13(2,3)8-7-11-9-12(14(4,5)6)16-10-15-11;1-13(2,3)8-7-11-9-12(14(4,5)6)16-15-10-11/h2*7-8,11H,9-10H2,1-6H3;9-10H,7-8H2,1-6H3;2*8,10H,7,9H2,1-6H3;9-10H,7-8H2,1-6H3;7-8H,9-10H2,1-6H3;3*9-10H,7-8H2,1-6H3.
What are the key properties of 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine?
2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine has a molecular weight of 2201.62 g/mol, XLogP of 38.34, 20 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(2,2-dimethylpropyl)pyrazine;bis(2,5-bis(2,2-dimethylpropyl)pyridine);2,4-bis(2,2-dimethylpropyl)pyrimidine;2-tert-butyl-6-(3,3-dimethylbutyl)pyrazine;3-tert-butyl-5-(3,3-dimethylbutyl)pyridazine;5-tert-butyl-3-(3,3-dimethylbutyl)pyridazine;2-tert-butyl-4-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-2-(3,3-dimethylbutyl)pyrimidine;4-tert-butyl-6-(3,3-dimethylbutyl)pyrimidine is sourced from PubChem (CID 157096341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).