2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine

C13H22N2 — CID 70520126

IUPAC2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine
SMILESCC(C)C(C)(C)C(C)(C)c1cnccn1
InChIInChI=1S/C13H22N2/c1-10(2)12(3,4)13(5,6)11-9-14-7-8-15-11/h7-10H,1-6H3
InChIKeyRJFTVIDHEBGCIL-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.44
Rot. Bonds3

About 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine

2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine (PubChem CID 70520126) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine.

Molecular Properties

Compound Name2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine
PubChem CID70520126
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine
SMILESCC(C)C(C)(C)C(C)(C)c1cnccn1
InChIInChI=1S/C13H22N2/c1-10(2)12(3,4)13(5,6)11-9-14-7-8-15-11/h7-10H,1-6H3
InChIKeyRJFTVIDHEBGCIL-UHFFFAOYSA-N
XLogP3.44
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Isobutyl-3-methyl pyrazine
CID 26333
2-Methyl-3-propylpyrazine
CID 85224
Propylpyrazine
CID 87466
(Cyclohexylmethyl)pyrazine
CID 16204532
2-Methyl-5-propylpyrazine
CID 122383
Pyrazine, (2-methylpropyl)-
CID 34591
Pentylpyrazine
CID 80551
2-Isobutyl-3,6-dimethyl-pyrazine
CID 520585
2,3-Dimethyl-5-(2-methylpropyl)pyrazine
CID 528108
2-Methyl-6-(3-methylbutyl)pyrazine
CID 572730
2,3-Dimethyl-5-propylpyrazine
CID 520566
2-Isobutyl-3,5-dimethyl-pyrazine
CID 578817

Frequently Asked Questions

What is the IUPAC name of 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine?
The IUPAC name of 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine (CID 70520126) is 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine.
What is the SMILES notation for 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine?
The canonical SMILES for 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine is CC(C)C(C)(C)C(C)(C)c1cnccn1.
What is the InChIKey of 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine?
The InChIKey is RJFTVIDHEBGCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-10(2)12(3,4)13(5,6)11-9-14-7-8-15-11/h7-10H,1-6H3.
What are the key properties of 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine?
2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine has a molecular weight of 206.33 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3,3,4-tetramethylpentan-2-yl)pyrazine is sourced from PubChem (CID 70520126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).