2,5-ditert-butyl-3,6-dimethylpyrazine

C14H24N2 — CID 143714636

IUPAC2,5-ditert-butyl-3,6-dimethylpyrazine
SMILESCc1nc(C(C)(C)C)c(C)nc1C(C)(C)C
InChIInChI=1S/C14H24N2/c1-9-11(13(3,4)5)16-10(2)12(15-9)14(6,7)8/h1-8H3
InChIKeyVJERRFDSWUHWPV-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.69
Rot. Bonds

About 2,5-ditert-butyl-3,6-dimethylpyrazine

2,5-ditert-butyl-3,6-dimethylpyrazine (PubChem CID 143714636) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2,5-ditert-butyl-3,6-dimethylpyrazine.

Molecular Properties

Compound Name2,5-ditert-butyl-3,6-dimethylpyrazine
PubChem CID143714636
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2,5-ditert-butyl-3,6-dimethylpyrazine
SMILESCc1nc(C(C)(C)C)c(C)nc1C(C)(C)C
InChIInChI=1S/C14H24N2/c1-9-11(13(3,4)5)16-10(2)12(15-9)14(6,7)8/h1-8H3
InChIKeyVJERRFDSWUHWPV-UHFFFAOYSA-N
XLogP3.69
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-ditert-butyl-3-methylquinoxaline
CID 134411062
(Z)-4-(5-tert-butyl-3,6-dimethylpyrazin-2-yl)but-3-en-2-amine
CID 134312170
5-bromo-3-tert-butyl-2-methylpyrazine
CID 118016282
2,5-ditert-butyl-3-methylquinoxaline
CID 134411080
1-tert-butyl-2,3,4,5,6-pentamethylbenzene;2-tert-butyl-3,4,5,6-tetramethylpyridine;3-tert-butyl-2,4,5,6-tetramethylpyridine;4-tert-butyl-2,3,5,6-tetramethylpyridine;2-tert-butyl-3,5,6-trimethylpyrazine;4-tert-butyl-2,5,6-trimethylpyrimidine
CID 167657431
4,5,6-tritert-butyl-2-methylpyrimidine
CID 21040087
2,6-ditert-butyl-4-methylpyridine-3,5-dicarbonitrile
CID 852569
2-tert-butyl-3-methylbenzo[f]quinoxaline
CID 170036564
3-tert-butyl-4,5,6-trimethylpyridazine
CID 58250590
3-tert-butyl-2-methyl-[1]benzothiolo[2,3-b]pyrazine
CID 177086881
3-tert-butyl-6-methylpyrazin-2-amine
CID 121309179
3-bromo-2-tert-butyl-5-methylpyrazine
CID 153298447

Frequently Asked Questions

What is the IUPAC name of 2,5-ditert-butyl-3,6-dimethylpyrazine?
The IUPAC name of 2,5-ditert-butyl-3,6-dimethylpyrazine (CID 143714636) is 2,5-ditert-butyl-3,6-dimethylpyrazine.
What is the SMILES notation for 2,5-ditert-butyl-3,6-dimethylpyrazine?
The canonical SMILES for 2,5-ditert-butyl-3,6-dimethylpyrazine is Cc1nc(C(C)(C)C)c(C)nc1C(C)(C)C.
What is the InChIKey of 2,5-ditert-butyl-3,6-dimethylpyrazine?
The InChIKey is VJERRFDSWUHWPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-9-11(13(3,4)5)16-10(2)12(15-9)14(6,7)8/h1-8H3.
What are the key properties of 2,5-ditert-butyl-3,6-dimethylpyrazine?
2,5-ditert-butyl-3,6-dimethylpyrazine has a molecular weight of 220.36 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-ditert-butyl-3,6-dimethylpyrazine is sourced from PubChem (CID 143714636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).