1,1,2,6,6,7-hexamethylindolo[7,6-g]indole

C20H22N2 — CID 11346820

IUPAC1,1,2,6,6,7-hexamethylindolo[7,6-g]indole
SMILESCC1=Nc2c(ccc3c4c(ccc23)C(C)(C)C(C)=N4)C1(C)C
InChIInChI=1S/C20H22N2/c1-11-19(3,4)15-9-7-14-13(17(15)21-11)8-10-16-18(14)22-12(2)20(16,5)6/h7-10H,1-6H3
InChIKeySGVWKDGTMYGPBK-UHFFFAOYSA-N
MW290.41 g/mol
LogP5.61
Rot. Bonds

About 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole

1,1,2,6,6,7-hexamethylindolo[7,6-g]indole (PubChem CID 11346820) has the molecular formula C20H22N2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole.

Molecular Properties

Compound Name1,1,2,6,6,7-hexamethylindolo[7,6-g]indole
PubChem CID11346820
Molecular FormulaC20H22N2
Molecular Weight290.41 g/mol
Exact Mass290.18
IUPAC Name1,1,2,6,6,7-hexamethylindolo[7,6-g]indole
SMILESCC1=Nc2c(ccc3c4c(ccc23)C(C)(C)C(C)=N4)C1(C)C
InChIInChI=1S/C20H22N2/c1-11-19(3,4)15-9-7-14-13(17(15)21-11)8-10-16-18(14)22-12(2)20(16,5)6/h7-10H,1-6H3
InChIKeySGVWKDGTMYGPBK-UHFFFAOYSA-N
XLogP5.61
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.41
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole?
The IUPAC name of 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole (CID 11346820) is 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole.
What is the SMILES notation for 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole?
The canonical SMILES for 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole is CC1=Nc2c(ccc3c4c(ccc23)C(C)(C)C(C)=N4)C1(C)C.
What is the InChIKey of 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole?
The InChIKey is SGVWKDGTMYGPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2/c1-11-19(3,4)15-9-7-14-13(17(15)21-11)8-10-16-18(14)22-12(2)20(16,5)6/h7-10H,1-6H3.
What are the key properties of 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole?
1,1,2,6,6,7-hexamethylindolo[7,6-g]indole has a molecular weight of 290.41 g/mol, XLogP of 5.61, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,6,6,7-hexamethylindolo[7,6-g]indole is sourced from PubChem (CID 11346820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).