4-tert-butyl-2,3-dihydro-1H-pyrazine

C8H16N2 — CID 59343103

IUPAC4-tert-butyl-2,3-dihydro-1H-pyrazine
SMILESCC(C)(C)N1C=CNCC1
InChIInChI=1S/C8H16N2/c1-8(2,3)10-6-4-9-5-7-10/h4,6,9H,5,7H2,1-3H3
InChIKeyLEDLAEUYPTWSRA-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.16
Rot. Bonds

About 4-tert-butyl-2,3-dihydro-1H-pyrazine

4-tert-butyl-2,3-dihydro-1H-pyrazine (PubChem CID 59343103) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 4-tert-butyl-2,3-dihydro-1H-pyrazine.

Molecular Properties

Compound Name4-tert-butyl-2,3-dihydro-1H-pyrazine
PubChem CID59343103
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name4-tert-butyl-2,3-dihydro-1H-pyrazine
SMILESCC(C)(C)N1C=CNCC1
InChIInChI=1S/C8H16N2/c1-8(2,3)10-6-4-9-5-7-10/h4,6,9H,5,7H2,1-3H3
InChIKeyLEDLAEUYPTWSRA-UHFFFAOYSA-N
XLogP1.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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1-tert-butyl-4-propan-2-yl-3,4-dihydro-2H-pyridine
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CID 59009704
CID 59009704
1-tert-butyl-2H-pyridine
CID 54401784
1-tert-butyl-4H-pyridine
CID 58984381
1-tert-butyl-3,3-dimethyl-2H-pyrrole
CID 90076789
3-trityl-1,2-dihydroimidazole
CID 154182196
1-tert-butyl-5-methyl-3,4-dihydro-2H-pyridine
CID 14932690
1-tert-butyl-3-ethyl-2H-imidazole
CID 68780965
1-tert-butylpiperazine;ethane;methane
CID 161367706
3-tert-butyl-1,6-dihydropyrimidin-2-one
CID 168837687
1-tert-butyl-3-methylidenepiperazine
CID 58564516

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2,3-dihydro-1H-pyrazine?
The IUPAC name of 4-tert-butyl-2,3-dihydro-1H-pyrazine (CID 59343103) is 4-tert-butyl-2,3-dihydro-1H-pyrazine.
What is the SMILES notation for 4-tert-butyl-2,3-dihydro-1H-pyrazine?
The canonical SMILES for 4-tert-butyl-2,3-dihydro-1H-pyrazine is CC(C)(C)N1C=CNCC1.
What is the InChIKey of 4-tert-butyl-2,3-dihydro-1H-pyrazine?
The InChIKey is LEDLAEUYPTWSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-8(2,3)10-6-4-9-5-7-10/h4,6,9H,5,7H2,1-3H3.
What are the key properties of 4-tert-butyl-2,3-dihydro-1H-pyrazine?
4-tert-butyl-2,3-dihydro-1H-pyrazine has a molecular weight of 140.23 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2,3-dihydro-1H-pyrazine is sourced from PubChem (CID 59343103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).