3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine

C14H16N2O — CID 82377049

IUPAC3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
SMILESCc1cccc(C)c1C1CNc2cocc2N1
InChIInChI=1S/C14H16N2O/c1-9-4-3-5-10(2)14(9)11-6-15-12-7-17-8-13(12)16-11/h3-5,7-8,11,15-16H,6H2,1-2H3
InChIKeyFNSVBFVKNDWWQU-UHFFFAOYSA-N
MW228.30 g/mol
LogP3.48
Rot. Bonds1

About 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine

3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine (PubChem CID 82377049) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine.

Molecular Properties

Compound Name3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
PubChem CID82377049
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
SMILESCc1cccc(C)c1C1CNc2cocc2N1
InChIInChI=1S/C14H16N2O/c1-9-4-3-5-10(2)14(9)11-6-15-12-7-17-8-13(12)16-11/h3-5,7-8,11,15-16H,6H2,1-2H3
InChIKeyFNSVBFVKNDWWQU-UHFFFAOYSA-N
XLogP3.48
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-methoxy-4-methylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
CID 82377046
(4S)-4-(2-chloro-6-methylphenyl)imidazolidin-2-one
CID 131150939
3-[(3-methoxyphenyl)methyl]-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine
CID 82377070
1,6-dimethyl-2,3-dihydro-1H-benzo[e]indole
CID 163282273
(8-methyl-3,4-dihydro-2H-1,4-benzoxazin-2-yl)methanol
CID 83816817
2,8-dimethyl-3,4-dihydro-2H-1,4-benzoxazine
CID 79001888
(2R)-2-(2,6-dimethylphenyl)piperidine;hydrochloride
CID 171195444
3-(2,6-dimethylphenyl)morpholine
CID 55298000
(3S)-3-(2,6-dimethylphenyl)pyrrolidine
CID 93478436
8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine
CID 59679612
3-(2,6-dimethylphenyl)piperidine;ethane
CID 143178371
2,8-dimethyl-3,4-dihydro-2H-1,4-benzothiazine
CID 114827412

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
The IUPAC name of 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine (CID 82377049) is 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine.
What is the SMILES notation for 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
The canonical SMILES for 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine is Cc1cccc(C)c1C1CNc2cocc2N1.
What is the InChIKey of 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
The InChIKey is FNSVBFVKNDWWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-9-4-3-5-10(2)14(9)11-6-15-12-7-17-8-13(12)16-11/h3-5,7-8,11,15-16H,6H2,1-2H3.
What are the key properties of 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine?
3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine has a molecular weight of 228.30 g/mol, XLogP of 3.48, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dimethylphenyl)-1,2,3,4-tetrahydrofuro[3,4-b]pyrazine is sourced from PubChem (CID 82377049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).