2-hydroxyethyl 2-naphthalen-2-yloxyacetate

C14H14O4 — CID 21297754

IUPAC2-hydroxyethyl 2-naphthalen-2-yloxyacetate
SMILESO=C(COc1ccc2ccccc2c1)OCCO
InChIInChI=1S/C14H14O4/c15-7-8-17-14(16)10-18-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9,15H,7-8,10H2
InChIKeyXHKSDUJZFQZOFT-UHFFFAOYSA-N
MW246.26 g/mol
LogP1.75
Rot. Bonds5

About 2-hydroxyethyl 2-naphthalen-2-yloxyacetate

2-hydroxyethyl 2-naphthalen-2-yloxyacetate (PubChem CID 21297754) has the molecular formula C14H14O4 and a molecular weight of 246.26 g/mol. Its IUPAC name is 2-hydroxyethyl 2-naphthalen-2-yloxyacetate.

Molecular Properties

Compound Name2-hydroxyethyl 2-naphthalen-2-yloxyacetate
PubChem CID21297754
Molecular FormulaC14H14O4
Molecular Weight246.26 g/mol
Exact Mass246.09
IUPAC Name2-hydroxyethyl 2-naphthalen-2-yloxyacetate
SMILESO=C(COc1ccc2ccccc2c1)OCCO
InChIInChI=1S/C14H14O4/c15-7-8-17-14(16)10-18-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9,15H,7-8,10H2
InChIKeyXHKSDUJZFQZOFT-UHFFFAOYSA-N
XLogP1.75
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromoethyl 2-naphthalen-2-yloxyacetate
CID 22163309
2-hydroxyethyl 2-(3-aminophenoxy)acetate
CID 61320594
[2-(2-acetylhydrazinyl)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 8821296
11-naphthalen-2-yloxyundecan-1-ol
CID 164916130
[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 9491672
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[3-[3-[3-[3-[3-[3-[3-[3-(3-naphthalen-2-yloxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 23534221
[2-(benzylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 2365439
2-hydroxyethyl 2-(9-sulfanylidenexanthen-2-yl)oxyacetate
CID 87217064
[2-(ethylcarbamoylamino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 2583176
[(1R)-1-cyanoethyl] 2-naphthalen-2-yloxyacetate
CID 8821377
[2-(2-methylanilino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 7843327
2-naphthalen-2-yloxyethanethioamide
CID 7454258

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl 2-naphthalen-2-yloxyacetate?
The IUPAC name of 2-hydroxyethyl 2-naphthalen-2-yloxyacetate (CID 21297754) is 2-hydroxyethyl 2-naphthalen-2-yloxyacetate.
What is the SMILES notation for 2-hydroxyethyl 2-naphthalen-2-yloxyacetate?
The canonical SMILES for 2-hydroxyethyl 2-naphthalen-2-yloxyacetate is O=C(COc1ccc2ccccc2c1)OCCO.
What is the InChIKey of 2-hydroxyethyl 2-naphthalen-2-yloxyacetate?
The InChIKey is XHKSDUJZFQZOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O4/c15-7-8-17-14(16)10-18-13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9,15H,7-8,10H2.
What are the key properties of 2-hydroxyethyl 2-naphthalen-2-yloxyacetate?
2-hydroxyethyl 2-naphthalen-2-yloxyacetate has a molecular weight of 246.26 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl 2-naphthalen-2-yloxyacetate is sourced from PubChem (CID 21297754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).