1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol

C10H10Cl2N2O — CID 44590872

IUPAC1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol
SMILESCC(O)c1nc2cc(Cl)c(Cl)cc2n1C
InChIInChI=1S/C10H10Cl2N2O/c1-5(15)10-13-8-3-6(11)7(12)4-9(8)14(10)2/h3-5,15H,1-2H3
InChIKeyFXDXVQPKKQXEHN-UHFFFAOYSA-N
MW245.11 g/mol
LogP2.93
Rot. Bonds1

About 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol

1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol (PubChem CID 44590872) has the molecular formula C10H10Cl2N2O and a molecular weight of 245.11 g/mol. Its IUPAC name is 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol
PubChem CID44590872
Molecular FormulaC10H10Cl2N2O
Molecular Weight245.11 g/mol
Exact Mass244.02
IUPAC Name1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol
SMILESCC(O)c1nc2cc(Cl)c(Cl)cc2n1C
InChIInChI=1S/C10H10Cl2N2O/c1-5(15)10-13-8-3-6(11)7(12)4-9(8)14(10)2/h3-5,15H,1-2H3
InChIKeyFXDXVQPKKQXEHN-UHFFFAOYSA-N
XLogP2.93
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.11
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethanol, 1-(1-methyl-2-benzimidazolyl)-
CID 97831
6-Chloro-1H-benzimidazole-2-methanol
CID 23383
(1-methyl-1H-1,3-benzodiazol-2-yl)methanol
CID 344177
5,6-dichloro-1-methyl-1H-1,3-benzodiazol-2-amine
CID 612073
5,6-Dichloro-1,2-dimethylbenzimidazole
CID 840715
2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol
CID 761926
1-(6-chloro-1-methyl-1H-1,3-benzodiazol-2-yl)ethan-1-one
CID 44590807
1-(5-chloro-1-methyl-1H-1,3-benzodiazol-2-yl)ethan-1-one
CID 44590868
1H-Benzimidazole, 5-chloro-1-ethyl-2-methyl-
CID 76064
1H-Benzimidazole, 5,6-dichloro-1-ethyl-2-methyl-
CID 76717
5-Chloro-1,2-dimethyl-1H-benzimidazole
CID 13032420
1H-Benzimidazole-1-propanol, 5,6-dichloro-2-methyl-
CID 86310

Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol?
The IUPAC name of 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol (CID 44590872) is 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol?
The canonical SMILES for 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol is CC(O)c1nc2cc(Cl)c(Cl)cc2n1C.
What is the InChIKey of 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol?
The InChIKey is FXDXVQPKKQXEHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N2O/c1-5(15)10-13-8-3-6(11)7(12)4-9(8)14(10)2/h3-5,15H,1-2H3.
What are the key properties of 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol?
1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol has a molecular weight of 245.11 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dichloro-1-methylbenzimidazol-2-yl)ethanol is sourced from PubChem (CID 44590872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).