4,7-dimethoxy-1,2-dimethylbenzimidazole

C11H14N2O2 — CID 86146082

IUPAC4,7-dimethoxy-1,2-dimethylbenzimidazole
SMILESCOc1ccc(OC)c2c1nc(C)n2C
InChIInChI=1S/C11H14N2O2/c1-7-12-10-8(14-3)5-6-9(15-4)11(10)13(7)2/h5-6H,1-4H3
InChIKeyLGYSNYZUVLTOHA-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.90
Rot. Bonds2

About 4,7-dimethoxy-1,2-dimethylbenzimidazole

4,7-dimethoxy-1,2-dimethylbenzimidazole (PubChem CID 86146082) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 4,7-dimethoxy-1,2-dimethylbenzimidazole.

Molecular Properties

Compound Name4,7-dimethoxy-1,2-dimethylbenzimidazole
PubChem CID86146082
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name4,7-dimethoxy-1,2-dimethylbenzimidazole
SMILESCOc1ccc(OC)c2c1nc(C)n2C
InChIInChI=1S/C11H14N2O2/c1-7-12-10-8(14-3)5-6-9(15-4)11(10)13(7)2/h5-6H,1-4H3
InChIKeyLGYSNYZUVLTOHA-UHFFFAOYSA-N
XLogP1.90
TPSA36.28 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 ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4,7-dimethoxy-1,2-dimethylbenzimidazole?
The IUPAC name of 4,7-dimethoxy-1,2-dimethylbenzimidazole (CID 86146082) is 4,7-dimethoxy-1,2-dimethylbenzimidazole.
What is the SMILES notation for 4,7-dimethoxy-1,2-dimethylbenzimidazole?
The canonical SMILES for 4,7-dimethoxy-1,2-dimethylbenzimidazole is COc1ccc(OC)c2c1nc(C)n2C.
What is the InChIKey of 4,7-dimethoxy-1,2-dimethylbenzimidazole?
The InChIKey is LGYSNYZUVLTOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-7-12-10-8(14-3)5-6-9(15-4)11(10)13(7)2/h5-6H,1-4H3.
What are the key properties of 4,7-dimethoxy-1,2-dimethylbenzimidazole?
4,7-dimethoxy-1,2-dimethylbenzimidazole has a molecular weight of 206.24 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethoxy-1,2-dimethylbenzimidazole is sourced from PubChem (CID 86146082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).