2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol

C13H17N3O2 — CID 46784646

IUPAC2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol
SMILESOCCn1c(N2CCOCC2)nc2ccccc21
InChIInChI=1S/C13H17N3O2/c17-8-5-16-12-4-2-1-3-11(12)14-13(16)15-6-9-18-10-7-15/h1-4,17H,5-10H2
InChIKeyYHADXRMNUADDQL-UHFFFAOYSA-N
MW247.30 g/mol
LogP0.87
Rot. Bonds3

About 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol

2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol (PubChem CID 46784646) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol.

Molecular Properties

Compound Name2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol
PubChem CID46784646
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol
SMILESOCCn1c(N2CCOCC2)nc2ccccc21
InChIInChI=1S/C13H17N3O2/c17-8-5-16-12-4-2-1-3-11(12)14-13(16)15-6-9-18-10-7-15/h1-4,17H,5-10H2
InChIKeyYHADXRMNUADDQL-UHFFFAOYSA-N
XLogP0.87
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-morpholin-4-ylbenzimidazol-1-yl)acetic acid
CID 46784645
4-(1-prop-2-enylbenzimidazol-2-yl)morpholine
CID 828615
4-[1-(4-phenoxybutyl)benzimidazol-2-yl]morpholine
CID 122190766
2-[2-(1,4-diazepan-1-yl)benzimidazol-1-yl]ethanol;hydroiodide
CID 86583903
methyl 2-(2-morpholin-4-ylbenzimidazol-1-yl)acetate
CID 66492644
[4-(1-ethylbenzimidazol-2-yl)piperazin-1-yl]-morpholin-4-ylmethanone
CID 3545151
trimethyl-[2-[(2-morpholin-4-ylbenzimidazol-1-yl)methoxy]ethyl]silane
CID 156708125
2-[2-[4-[(E)-3-(furan-2-yl)-2-methylprop-2-enyl]piperazin-1-yl]benzimidazol-1-yl]ethanol
CID 50981831
2-(2-piperazin-1-ylbenzimidazol-1-yl)ethanamine
CID 83417374
2-(2-methylbenzimidazol-1-yl)ethanol
CID 761926
4-[1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]benzimidazol-2-yl]morpholine
CID 56914288
2-[2-[4-[1-(2-hydroxyethyl)benzimidazol-2-yl]phenyl]benzimidazol-1-yl]ethanol
CID 174213303

Frequently Asked Questions

What is the IUPAC name of 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol?
The IUPAC name of 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol (CID 46784646) is 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol.
What is the SMILES notation for 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol?
The canonical SMILES for 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol is OCCn1c(N2CCOCC2)nc2ccccc21.
What is the InChIKey of 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol?
The InChIKey is YHADXRMNUADDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c17-8-5-16-12-4-2-1-3-11(12)14-13(16)15-6-9-18-10-7-15/h1-4,17H,5-10H2.
What are the key properties of 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol?
2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol has a molecular weight of 247.30 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylbenzimidazol-1-yl)ethanol is sourced from PubChem (CID 46784646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).