5-(furan-2-ylmethyl)-2,3-dimethylpyrazine

C11H12N2O — CID 12558437

IUPAC5-(furan-2-ylmethyl)-2,3-dimethylpyrazine
SMILESCc1ncc(Cc2ccco2)nc1C
InChIInChI=1S/C11H12N2O/c1-8-9(2)13-10(7-12-8)6-11-4-3-5-14-11/h3-5,7H,6H2,1-2H3
InChIKeyBJRDEVWHCHYELK-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.28
Rot. Bonds2

About 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine

5-(furan-2-ylmethyl)-2,3-dimethylpyrazine (PubChem CID 12558437) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine.

Molecular Properties

Compound Name5-(furan-2-ylmethyl)-2,3-dimethylpyrazine
PubChem CID12558437
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name5-(furan-2-ylmethyl)-2,3-dimethylpyrazine
SMILESCc1ncc(Cc2ccco2)nc1C
InChIInChI=1S/C11H12N2O/c1-8-9(2)13-10(7-12-8)6-11-4-3-5-14-11/h3-5,7H,6H2,1-2H3
InChIKeyBJRDEVWHCHYELK-UHFFFAOYSA-N
XLogP2.28
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(furan-2-ylmethyl)oxadiazole
CID 174840733
2-bromo-5-(furan-2-ylmethyl)-1,3-thiazole
CID 117259797
[2-(furan-2-ylmethoxy)-4-methylpyrimidin-5-yl]methanol
CID 83184642
2-(furan-2-ylmethyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 83969596
4-(furan-2-ylmethoxy)-N,5-dimethylpyrimidin-2-amine
CID 80859183
2-chloro-6-(furan-2-ylmethyl)-4-(trichloromethyl)pyridine
CID 56622235
5-bromo-2-(furan-2-ylmethyl)-1,3-thiazole
CID 117259115
2-(furan-2-ylmethyl)imidazo[1,2-a]pyridin-8-ol
CID 117137864
2-(furan-2-yl)-1-(2-methylpyrimidin-4-yl)ethanol
CID 83171939
5-bromo-N-cyclopropyl-N-(furan-2-ylmethyl)-4-methylpyridin-2-amine
CID 115773896
6-(furan-2-ylmethyl)-2-methyl-5-phenylthieno[2,3-d]pyrimidine
CID 123393467
[3-(furan-2-ylmethyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 115004199

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine?
The IUPAC name of 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine (CID 12558437) is 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine.
What is the SMILES notation for 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine?
The canonical SMILES for 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine is Cc1ncc(Cc2ccco2)nc1C.
What is the InChIKey of 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine?
The InChIKey is BJRDEVWHCHYELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-8-9(2)13-10(7-12-8)6-11-4-3-5-14-11/h3-5,7H,6H2,1-2H3.
What are the key properties of 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine?
5-(furan-2-ylmethyl)-2,3-dimethylpyrazine has a molecular weight of 188.23 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethyl)-2,3-dimethylpyrazine is sourced from PubChem (CID 12558437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).