2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline

C23H18N2O — CID 163829279

IUPAC2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline
SMILESCC(C)c1nc2ccccc2nc1-c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C23H18N2O/c1-14(2)22-23(25-19-9-5-4-8-18(19)24-22)15-11-12-17-16-7-3-6-10-20(16)26-21(17)13-15/h3-14H,1-2H3
InChIKeyZBWYUSJNLMIPRG-UHFFFAOYSA-N
MW338.41 g/mol
LogP6.32
Rot. Bonds2

About 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline

2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline (PubChem CID 163829279) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline.

Molecular Properties

Compound Name2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline
PubChem CID163829279
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC Name2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline
SMILESCC(C)c1nc2ccccc2nc1-c1ccc2c(c1)oc1ccccc12
InChIInChI=1S/C23H18N2O/c1-14(2)22-23(25-19-9-5-4-8-18(19)24-22)15-11-12-17-16-7-3-6-10-20(16)26-21(17)13-15/h3-14H,1-2H3
InChIKeyZBWYUSJNLMIPRG-UHFFFAOYSA-N
XLogP6.32
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 56.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-dibenzofuran-3-yl-3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]quinoxaline
CID 168746371
3-naphthalen-2-yldibenzofuran
CID 68932481
2-dibenzofuran-3-yl-3-(9,9,10,10-tetramethylphenanthren-2-yl)quinoxaline
CID 163862522
2-dibenzofuran-3-yl-3-(16,16-dimethyl-6-hexacyclo[12.11.0.02,11.03,8.015,23.017,22]pentacosa-1(14),2(11),3(8),4,6,9,12,15(23),17,19,21,24-dodecaenyl)quinoxaline
CID 163833115
2-dibenzofuran-3-yl-3-(22-thiahexacyclo[12.11.0.02,11.03,8.015,23.016,21]pentacosa-1(14),2(11),3(8),4,6,9,12,15(23),16,18,20,24-dodecaen-6-yl)quinoxaline
CID 163798485
3-(3-dibenzofuran-3-yl-5-phenanthren-3-ylphenyl)dibenzofuran
CID 118488750
3-[4-[4-(4-methylphenyl)phenyl]phenyl]dibenzofuran
CID 67964733
2-dibenzofuran-3-yl-4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazine
CID 177119872
2-dibenzofuran-3-yl-3-[9,9,10,10-tetramethyl-6-(3-phenylphenyl)phenanthren-2-yl]quinoxaline
CID 163805854
2-dibenzofuran-3-yl-4-phenyl-6-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3,5-triazine
CID 138729900
2-dibenzofuran-3-yl-4-(4-phenylphenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 138729899
2-phenyl-3-[8-(3-phenylquinoxalin-2-yl)dibenzofuran-2-yl]quinoxaline
CID 3123808

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline?
The IUPAC name of 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline (CID 163829279) is 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline.
What is the SMILES notation for 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline?
The canonical SMILES for 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline is CC(C)c1nc2ccccc2nc1-c1ccc2c(c1)oc1ccccc12.
What is the InChIKey of 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline?
The InChIKey is ZBWYUSJNLMIPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c1-14(2)22-23(25-19-9-5-4-8-18(19)24-22)15-11-12-17-16-7-3-6-10-20(16)26-21(17)13-15/h3-14H,1-2H3.
What are the key properties of 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline?
2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline has a molecular weight of 338.41 g/mol, XLogP of 6.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-3-yl-3-propan-2-ylquinoxaline is sourced from PubChem (CID 163829279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).