5-methoxy-1,2-dimethylbenzimidazole

C10H12N2O — CID 11126799

IUPAC5-methoxy-1,2-dimethylbenzimidazole
SMILESCOc1ccc2c(c1)nc(C)n2C
InChIInChI=1S/C10H12N2O/c1-7-11-9-6-8(13-3)4-5-10(9)12(7)2/h4-6H,1-3H3
InChIKeyNVNUBOSZEJYDHC-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.89
Rot. Bonds1

About 5-methoxy-1,2-dimethylbenzimidazole

5-methoxy-1,2-dimethylbenzimidazole (PubChem CID 11126799) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 5-methoxy-1,2-dimethylbenzimidazole.

Molecular Properties

Compound Name5-methoxy-1,2-dimethylbenzimidazole
PubChem CID11126799
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name5-methoxy-1,2-dimethylbenzimidazole
SMILESCOc1ccc2c(c1)nc(C)n2C
InChIInChI=1S/C10H12N2O/c1-7-11-9-6-8(13-3)4-5-10(9)12(7)2/h4-6H,1-3H3
InChIKeyNVNUBOSZEJYDHC-UHFFFAOYSA-N
XLogP1.89
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1,2-dimethylbenzimidazole?
The IUPAC name of 5-methoxy-1,2-dimethylbenzimidazole (CID 11126799) is 5-methoxy-1,2-dimethylbenzimidazole.
What is the SMILES notation for 5-methoxy-1,2-dimethylbenzimidazole?
The canonical SMILES for 5-methoxy-1,2-dimethylbenzimidazole is COc1ccc2c(c1)nc(C)n2C.
What is the InChIKey of 5-methoxy-1,2-dimethylbenzimidazole?
The InChIKey is NVNUBOSZEJYDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-7-11-9-6-8(13-3)4-5-10(9)12(7)2/h4-6H,1-3H3.
What are the key properties of 5-methoxy-1,2-dimethylbenzimidazole?
5-methoxy-1,2-dimethylbenzimidazole has a molecular weight of 176.22 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1,2-dimethylbenzimidazole is sourced from PubChem (CID 11126799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).