(6-bromo-1-ethylbenzimidazol-2-yl)methanol

C10H11BrN2O — CID 67247825

IUPAC(6-bromo-1-ethylbenzimidazol-2-yl)methanol
SMILESCCn1c(CO)nc2ccc(Br)cc21
InChIInChI=1S/C10H11BrN2O/c1-2-13-9-5-7(11)3-4-8(9)12-10(13)6-14/h3-5,14H,2,6H2,1H3
InChIKeyYTFDHVQXFQLOPW-UHFFFAOYSA-N
MW255.11 g/mol
LogP2.31
Rot. Bonds2

About (6-bromo-1-ethylbenzimidazol-2-yl)methanol

(6-bromo-1-ethylbenzimidazol-2-yl)methanol (PubChem CID 67247825) has the molecular formula C10H11BrN2O and a molecular weight of 255.11 g/mol. Its IUPAC name is (6-bromo-1-ethylbenzimidazol-2-yl)methanol.

Molecular Properties

Compound Name(6-bromo-1-ethylbenzimidazol-2-yl)methanol
PubChem CID67247825
Molecular FormulaC10H11BrN2O
Molecular Weight255.11 g/mol
Exact Mass254.01
IUPAC Name(6-bromo-1-ethylbenzimidazol-2-yl)methanol
SMILESCCn1c(CO)nc2ccc(Br)cc21
InChIInChI=1S/C10H11BrN2O/c1-2-13-9-5-7(11)3-4-8(9)12-10(13)6-14/h3-5,14H,2,6H2,1H3
InChIKeyYTFDHVQXFQLOPW-UHFFFAOYSA-N
XLogP2.31
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 ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethanol, 1-(1-methyl-2-benzimidazolyl)-
CID 97831
(1-methyl-1H-1,3-benzodiazol-2-yl)methanol
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2-(2-Methyl-1H-benzimidazol-1-yl)ethan-1-ol
CID 761926
4-bromo-N-[(1-methylbenzimidazol-2-yl)methyl]aniline
CID 756794
2-(2-Chloro-benzoimidazol-1-yl)-ethanol
CID 1089243
2-((1-methyl-1H-1,3-benzodiazol-2-yl)amino)ethan-1-ol
CID 2772787
1-(2-Bromoprop-2-enyl)-2-butylbenzimidazole
CID 659544
4-bromo-N-[(1-propylbenzimidazol-2-yl)methyl]aniline
CID 5308191
1-(2-Ethoxyethyl)-2-ethyl-1H-benzimidazole
CID 3155314
1-(2-Hydroxyethyl)benzimidazole
CID 228131
6-bromo-4-fluoro-1-isopropyl-2-methyl-1H-benzo(d)imidazole
CID 56971662
(1-benzyl-1H-1,3-benzodiazol-2-yl)methanol
CID 763580

Frequently Asked Questions

What is the IUPAC name of (6-bromo-1-ethylbenzimidazol-2-yl)methanol?
The IUPAC name of (6-bromo-1-ethylbenzimidazol-2-yl)methanol (CID 67247825) is (6-bromo-1-ethylbenzimidazol-2-yl)methanol.
What is the SMILES notation for (6-bromo-1-ethylbenzimidazol-2-yl)methanol?
The canonical SMILES for (6-bromo-1-ethylbenzimidazol-2-yl)methanol is CCn1c(CO)nc2ccc(Br)cc21.
What is the InChIKey of (6-bromo-1-ethylbenzimidazol-2-yl)methanol?
The InChIKey is YTFDHVQXFQLOPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O/c1-2-13-9-5-7(11)3-4-8(9)12-10(13)6-14/h3-5,14H,2,6H2,1H3.
What are the key properties of (6-bromo-1-ethylbenzimidazol-2-yl)methanol?
(6-bromo-1-ethylbenzimidazol-2-yl)methanol has a molecular weight of 255.11 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-1-ethylbenzimidazol-2-yl)methanol is sourced from PubChem (CID 67247825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).