2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol

C11H15N3O2 — CID 791808

IUPAC2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol
SMILESOCCN(CCO)c1nc2ccccc2[nH]1
InChIInChI=1S/C11H15N3O2/c15-7-5-14(6-8-16)11-12-9-3-1-2-4-10(9)13-11/h1-4,15-16H,5-8H2,(H,12,13)
InChIKeyAXHVAQJODYIXFO-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.35
Rot. Bonds5

About 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol

2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol (PubChem CID 791808) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol
PubChem CID791808
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol
SMILESOCCN(CCO)c1nc2ccccc2[nH]1
InChIInChI=1S/C11H15N3O2/c15-7-5-14(6-8-16)11-12-9-3-1-2-4-10(9)13-11/h1-4,15-16H,5-8H2,(H,12,13)
InChIKeyAXHVAQJODYIXFO-UHFFFAOYSA-N
XLogP0.35
TPSA72.38 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol (CID 791808) is 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol is OCCN(CCO)c1nc2ccccc2[nH]1.
What is the InChIKey of 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol?
The InChIKey is AXHVAQJODYIXFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-7-5-14(6-8-16)11-12-9-3-1-2-4-10(9)13-11/h1-4,15-16H,5-8H2,(H,12,13).
What are the key properties of 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol?
2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol has a molecular weight of 221.26 g/mol, XLogP of 0.35, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1H-benzimidazol-2-yl(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 791808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).