4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole

C20H19NO — CID 130318219

IUPAC4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole
SMILESCc1cccc(C)c1-n1c2ccccc2c2oc(C)c(C)c21
InChIInChI=1S/C20H19NO/c1-12-8-7-9-13(2)18(12)21-17-11-6-5-10-16(17)20-19(21)14(3)15(4)22-20/h5-11H,1-4H3
InChIKeyVPQRQRJSQBZCRE-UHFFFAOYSA-N
MW289.38 g/mol
LogP5.61
Rot. Bonds1

About 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole

4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole (PubChem CID 130318219) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole.

Molecular Properties

Compound Name4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole
PubChem CID130318219
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC Name4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole
SMILESCc1cccc(C)c1-n1c2ccccc2c2oc(C)c(C)c21
InChIInChI=1S/C20H19NO/c1-12-8-7-9-13(2)18(12)21-17-11-6-5-10-16(17)20-19(21)14(3)15(4)22-20/h5-11H,1-4H3
InChIKeyVPQRQRJSQBZCRE-UHFFFAOYSA-N
XLogP5.61
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.38
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,6-dimethylphenyl)-2-methylfuro[3,2-b]indol-3-amine
CID 130322518
4-(2,6-dimethylphenyl)-2-methylfuro[2,3-b]indol-1-amine
CID 130322187
9-[2,3,4,5-tetra(carbazol-9-yl)-6-methylphenyl]carbazole
CID 147406745
9-[4-(2,3-dimethyl-1-benzofuran-7-yl)phenyl]carbazole
CID 123396912
9-[4,6-bis(1-methylcarbazol-9-yl)-1,3,5-triazin-2-yl]-1-methylcarbazole
CID 23399530
3-(2,6-dimethylphenyl)-1H-benzimidazole-2-thione
CID 82088501
9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole
CID 67374081
1-(2,6-dimethylphenyl)-3-methylpyrrolo[2,3-a]indolizin-2-amine
CID 130322174
5-[3-carbazol-9-yl-9-(2,6-dimethylphenyl)carbazol-1-yl]benzene-1,3-dicarbonitrile
CID 134598218
10-(3-carbazol-9-ylphenyl)-[1]benzofuro[3,2-b]indole
CID 121298634
10-phenyl-6-(9-phenylcarbazol-4-yl)-[1]benzofuro[3,2-b]indole
CID 164828310
9-(9-methyl-4-phenyldibenzofuran-2-yl)carbazole
CID 167228990

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole?
The IUPAC name of 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole (CID 130318219) is 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole.
What is the SMILES notation for 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole?
The canonical SMILES for 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole is Cc1cccc(C)c1-n1c2ccccc2c2oc(C)c(C)c21.
What is the InChIKey of 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole?
The InChIKey is VPQRQRJSQBZCRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-12-8-7-9-13(2)18(12)21-17-11-6-5-10-16(17)20-19(21)14(3)15(4)22-20/h5-11H,1-4H3.
What are the key properties of 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole?
4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole has a molecular weight of 289.38 g/mol, XLogP of 5.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylphenyl)-2,3-dimethylfuro[3,2-b]indole is sourced from PubChem (CID 130318219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).