5,6-dimethoxy-2,2-dimethylbenzimidazole

C11H14N2O2 — CID 90686624

IUPAC5,6-dimethoxy-2,2-dimethylbenzimidazole
SMILESCOc1cc2c(cc1OC)=NC(C)(C)N=2
InChIInChI=1S/C11H14N2O2/c1-11(2)12-7-5-9(14-3)10(15-4)6-8(7)13-11/h5-6H,1-4H3
InChIKeyQLQXSTRXGBYVIL-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.69
Rot. Bonds2

About 5,6-dimethoxy-2,2-dimethylbenzimidazole

5,6-dimethoxy-2,2-dimethylbenzimidazole (PubChem CID 90686624) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 5,6-dimethoxy-2,2-dimethylbenzimidazole.

Molecular Properties

Compound Name5,6-dimethoxy-2,2-dimethylbenzimidazole
PubChem CID90686624
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name5,6-dimethoxy-2,2-dimethylbenzimidazole
SMILESCOc1cc2c(cc1OC)=NC(C)(C)N=2
InChIInChI=1S/C11H14N2O2/c1-11(2)12-7-5-9(14-3)10(15-4)6-8(7)13-11/h5-6H,1-4H3
InChIKeyQLQXSTRXGBYVIL-UHFFFAOYSA-N
XLogP0.69
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethoxy-2,2-dimethylbenzimidazole?
The IUPAC name of 5,6-dimethoxy-2,2-dimethylbenzimidazole (CID 90686624) is 5,6-dimethoxy-2,2-dimethylbenzimidazole.
What is the SMILES notation for 5,6-dimethoxy-2,2-dimethylbenzimidazole?
The canonical SMILES for 5,6-dimethoxy-2,2-dimethylbenzimidazole is COc1cc2c(cc1OC)=NC(C)(C)N=2.
What is the InChIKey of 5,6-dimethoxy-2,2-dimethylbenzimidazole?
The InChIKey is QLQXSTRXGBYVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-11(2)12-7-5-9(14-3)10(15-4)6-8(7)13-11/h5-6H,1-4H3.
What are the key properties of 5,6-dimethoxy-2,2-dimethylbenzimidazole?
5,6-dimethoxy-2,2-dimethylbenzimidazole has a molecular weight of 206.24 g/mol, XLogP of 0.69, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethoxy-2,2-dimethylbenzimidazole is sourced from PubChem (CID 90686624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).