1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol

C11H13BrN2O — CID 63023634

IUPAC1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol
SMILESCCn1c(C(C)O)nc2cc(Br)ccc21
InChIInChI=1S/C11H13BrN2O/c1-3-14-10-5-4-8(12)6-9(10)13-11(14)7(2)15/h4-7,15H,3H2,1-2H3
InChIKeyVGDMRDIFHIJJLO-UHFFFAOYSA-N
MW269.14 g/mol
LogP2.87
Rot. Bonds2

About 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol

1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol (PubChem CID 63023634) has the molecular formula C11H13BrN2O and a molecular weight of 269.14 g/mol. Its IUPAC name is 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol
PubChem CID63023634
Molecular FormulaC11H13BrN2O
Molecular Weight269.14 g/mol
Exact Mass268.02
IUPAC Name1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol
SMILESCCn1c(C(C)O)nc2cc(Br)ccc21
InChIInChI=1S/C11H13BrN2O/c1-3-14-10-5-4-8(12)6-9(10)13-11(14)7(2)15/h4-7,15H,3H2,1-2H3
InChIKeyVGDMRDIFHIJJLO-UHFFFAOYSA-N
XLogP2.87
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.14
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(5-bromo-1-ethylbenzimidazol-2-yl)ethyl]propan-1-amine
CID 63023819
5-bromo-1-ethylbenzimidazole-2-carbaldehyde
CID 63772017
1-amino-1-(1-ethyl-5-methylbenzimidazol-2-yl)propan-2-ol
CID 60785614
1-(5-bromo-1-ethylbenzimidazol-2-yl)-N-ethylpropan-2-amine
CID 62828331
3-(5-bromo-1-propylbenzimidazol-2-yl)butan-1-amine
CID 80539744
2-(5-bromo-1-ethylbenzimidazol-2-yl)acetonitrile
CID 82332810
2-[5-bromo-2-(1-chloroethyl)benzimidazol-1-yl]-N-methylacetamide
CID 43667469
2-[5-bromo-2-(1-chloroethyl)benzimidazol-1-yl]-N-ethyl-N-methylethanamine
CID 62640923
5-chloro-2-(1-chloroethyl)-1-ethylbenzimidazole
CID 43666414
2-[(1S)-1-hydroxyethyl]-1-propylbenzimidazole-5-carbonitrile
CID 66263869
2-(5-bromo-1-ethylbenzimidazol-2-yl)benzene-1,4-diol
CID 136903750
4-[5-bromo-2-(1-chloroethyl)benzimidazol-1-yl]butanamide
CID 60863620

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol?
The IUPAC name of 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol (CID 63023634) is 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol?
The canonical SMILES for 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol is CCn1c(C(C)O)nc2cc(Br)ccc21.
What is the InChIKey of 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol?
The InChIKey is VGDMRDIFHIJJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2O/c1-3-14-10-5-4-8(12)6-9(10)13-11(14)7(2)15/h4-7,15H,3H2,1-2H3.
What are the key properties of 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol?
1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol has a molecular weight of 269.14 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-1-ethylbenzimidazol-2-yl)ethanol is sourced from PubChem (CID 63023634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).