6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole

C10H11BrN2O2 — CID 165348636

IUPAC6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole
SMILESCOc1cc(Br)c(OC)c2[nH]c(C)nc12
InChIInChI=1S/C10H11BrN2O2/c1-5-12-8-7(14-2)4-6(11)10(15-3)9(8)13-5/h4H,1-3H3,(H,12,13)
InChIKeyGJQHJOXZSKPORJ-UHFFFAOYSA-N
MW271.11 g/mol
LogP2.65
Rot. Bonds2

About 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole

6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole (PubChem CID 165348636) has the molecular formula C10H11BrN2O2 and a molecular weight of 271.11 g/mol. Its IUPAC name is 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole.

Molecular Properties

Compound Name6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole
PubChem CID165348636
Molecular FormulaC10H11BrN2O2
Molecular Weight271.11 g/mol
Exact Mass270.00
IUPAC Name6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole
SMILESCOc1cc(Br)c(OC)c2[nH]c(C)nc12
InChIInChI=1S/C10H11BrN2O2/c1-5-12-8-7(14-2)4-6(11)10(15-3)9(8)13-5/h4H,1-3H3,(H,12,13)
InChIKeyGJQHJOXZSKPORJ-UHFFFAOYSA-N
XLogP2.65
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.11
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-2,4-dimethyl-7-propan-2-yl-1H-benzimidazole
CID 169298302
6-chloro-4-methoxy-2-methyl-1H-benzimidazole
CID 118993823
7,8-dimethoxy-2-methyl-3H-imidazo[4,5-c]quinoline
CID 156713420
2-bromo-1,4,5,7,8-pentamethoxynaphthalene
CID 139206863
methyl 4-bromo-6,7-dimethoxy-1H-indole-2-carboxylate
CID 7144594
1-bromo-3-(isocyanatomethyl)-2,4,5-trimethoxybenzene
CID 117486065
8-bromo-2,6-dimethyl-1H-quinazoline-4-thione
CID 106505564
3-bromo-5-methoxy-6-methylpyridin-2-amine
CID 130133402
5-bromo-8-methoxy-2-methylquinolin-4-amine
CID 62196790
5-bromo-4-methoxy-7-methyl-1H-indazole
CID 167501479
6-bromo-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalene
CID 15354623
7-bromo-5-methoxy-3-methyl-1H-quinoxalin-2-one
CID 71295705

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole?
The IUPAC name of 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole (CID 165348636) is 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole.
What is the SMILES notation for 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole?
The canonical SMILES for 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole is COc1cc(Br)c(OC)c2[nH]c(C)nc12.
What is the InChIKey of 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole?
The InChIKey is GJQHJOXZSKPORJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O2/c1-5-12-8-7(14-2)4-6(11)10(15-3)9(8)13-5/h4H,1-3H3,(H,12,13).
What are the key properties of 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole?
6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole has a molecular weight of 271.11 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4,7-dimethoxy-2-methyl-1H-benzimidazole is sourced from PubChem (CID 165348636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).