2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol

C11H15N3O — CID 116857291

IUPAC2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol
SMILESCN(C)C(CO)c1ccc2nc[nH]c2c1
InChIInChI=1S/C11H15N3O/c1-14(2)11(6-15)8-3-4-9-10(5-8)13-7-12-9/h3-5,7,11,15H,6H2,1-2H3,(H,12,13)
InChIKeyCKSYVSALVYNOII-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.16
Rot. Bonds3

About 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol

2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol (PubChem CID 116857291) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol.

Molecular Properties

Compound Name2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol
PubChem CID116857291
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol
SMILESCN(C)C(CO)c1ccc2nc[nH]c2c1
InChIInChI=1S/C11H15N3O/c1-14(2)11(6-15)8-3-4-9-10(5-8)13-7-12-9/h3-5,7,11,15H,6H2,1-2H3,(H,12,13)
InChIKeyCKSYVSALVYNOII-UHFFFAOYSA-N
XLogP1.16
TPSA52.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-(3H-benzimidazol-5-yl)-3-(dimethylamino)propanoate
CID 116910225
5-(3H-benzimidazol-5-yl)-5-(dimethylamino)pentan-2-one
CID 116910664
1-(3H-benzimidazol-5-yl)-1-N,1-N,3-trimethylbutane-1,3-diamine
CID 116905075
2-amino-2-(3H-benzimidazol-5-yl)ethanol
CID 70374087
(2S)-2-amino-2-(3H-benzimidazol-5-yl)ethanol
CID 96741805
2,3-diamino-3-(3H-benzimidazol-5-yl)propan-1-ol
CID 116942422
2-(3H-benzimidazol-5-yl)-2-(dimethylamino)acetonitrile
CID 116909829
6-pentan-3-yl-1H-benzimidazole
CID 134401277
ethyl 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)acetate
CID 116914274
1-(3H-benzimidazol-5-yl)-2-ethyl-N,N-dimethylpropane-1,3-diamine
CID 116913369
2-[3H-benzimidazol-5-yl(dimethylamino)methyl]-3-methylbutanenitrile
CID 116913817
N-[amino(3H-benzimidazol-5-yl)methyl]hydroxylamine
CID 163537798

Frequently Asked Questions

What is the IUPAC name of 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol?
The IUPAC name of 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol (CID 116857291) is 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol.
What is the SMILES notation for 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol?
The canonical SMILES for 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol is CN(C)C(CO)c1ccc2nc[nH]c2c1.
What is the InChIKey of 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol?
The InChIKey is CKSYVSALVYNOII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-14(2)11(6-15)8-3-4-9-10(5-8)13-7-12-9/h3-5,7,11,15H,6H2,1-2H3,(H,12,13).
What are the key properties of 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol?
2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol has a molecular weight of 205.26 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3H-benzimidazol-5-yl)-2-(dimethylamino)ethanol is sourced from PubChem (CID 116857291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).