2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol

C10H11BrN2O — CID 170642856

IUPAC2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol
SMILESCc1nc2ccc(Br)cc2n1CCO
InChIInChI=1S/C10H11BrN2O/c1-7-12-9-3-2-8(11)6-10(9)13(7)4-5-14/h2-3,6,14H,4-5H2,1H3
InChIKeySWQDEXFGURSEJJ-UHFFFAOYSA-N
MW255.11 g/mol
LogP2.10
Rot. Bonds2

About 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol

2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol (PubChem CID 170642856) has the molecular formula C10H11BrN2O and a molecular weight of 255.11 g/mol. Its IUPAC name is 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol
PubChem CID170642856
Molecular FormulaC10H11BrN2O
Molecular Weight255.11 g/mol
Exact Mass254.01
IUPAC Name2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol
SMILESCc1nc2ccc(Br)cc2n1CCO
InChIInChI=1S/C10H11BrN2O/c1-7-12-9-3-2-8(11)6-10(9)13(7)4-5-14/h2-3,6,14H,4-5H2,1H3
InChIKeySWQDEXFGURSEJJ-UHFFFAOYSA-N
XLogP2.10
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.11
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol?
The IUPAC name of 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol (CID 170642856) is 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol.
What is the SMILES notation for 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol?
The canonical SMILES for 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol is Cc1nc2ccc(Br)cc2n1CCO.
What is the InChIKey of 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol?
The InChIKey is SWQDEXFGURSEJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O/c1-7-12-9-3-2-8(11)6-10(9)13(7)4-5-14/h2-3,6,14H,4-5H2,1H3.
What are the key properties of 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol?
2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol has a molecular weight of 255.11 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-2-methylbenzimidazol-1-yl)ethanol is sourced from PubChem (CID 170642856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).