2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol

C12H17NO4 — CID 175076487

IUPAC2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol
SMILESOCCON(C=Cc1ccccc1)OCCO
InChIInChI=1S/C12H17NO4/c14-8-10-16-13(17-11-9-15)7-6-12-4-2-1-3-5-12/h1-7,14-15H,8-11H2
InChIKeyHSPMJEYENMGBIN-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.81
Rot. Bonds8

About 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol

2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol (PubChem CID 175076487) has the molecular formula C12H17NO4 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol.

Molecular Properties

Compound Name2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol
PubChem CID175076487
Molecular FormulaC12H17NO4
Molecular Weight239.27 g/mol
Exact Mass239.12
IUPAC Name2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol
SMILESOCCON(C=Cc1ccccc1)OCCO
InChIInChI=1S/C12H17NO4/c14-8-10-16-13(17-11-9-15)7-6-12-4-2-1-3-5-12/h1-7,14-15H,8-11H2
InChIKeyHSPMJEYENMGBIN-UHFFFAOYSA-N
XLogP0.81
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

boric acid;2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol
CID 175076486
2-[(Z)-3-phenylprop-2-enoxy]ethanol
CID 11679907
2-[4-[2-[4-[bis(2-hydroxyethoxy)amino]phenyl]ethenyl]-N-(2-hydroxyethoxy)anilino]oxyethanol
CID 173272020
2-[2-(2-phenylethenyl)phenoxy]ethanol
CID 70576558
2-[methyl-[(E)-3-phenylprop-2-enyl]amino]ethanol
CID 14988338
disodium;hydride;(E)-stilbene
CID 173089328
hydride;rubidium(1+);stilbene
CID 173437843
4-[2-[4-[bis(2-hydroxyethoxy)amino]phenyl]ethenyl]benzaldehyde
CID 173326260
3-[2-[(E)-2-phenylethenyl]phenoxy]propan-1-ol
CID 21078223
benzene;2-[chloro(2-hydroxyethoxy)amino]oxyethanol
CID 174400425
2-[2,3-bis[(E)-2-phenylethenyl]phenoxy]ethanol
CID 162493938
ethane-1,2-diol;(Z)-3-phenylprop-2-enal
CID 155351611

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol?
The IUPAC name of 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol (CID 175076487) is 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol.
What is the SMILES notation for 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol?
The canonical SMILES for 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol is OCCON(C=Cc1ccccc1)OCCO.
What is the InChIKey of 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol?
The InChIKey is HSPMJEYENMGBIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO4/c14-8-10-16-13(17-11-9-15)7-6-12-4-2-1-3-5-12/h1-7,14-15H,8-11H2.
What are the key properties of 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol?
2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol has a molecular weight of 239.27 g/mol, XLogP of 0.81, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethoxy(2-phenylethenyl)amino]oxyethanol is sourced from PubChem (CID 175076487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).