ethyl 2-(3-hydroxyanilino)acetate

C10H13NO3 — CID 22630327

IUPACethyl 2-(3-hydroxyanilino)acetate
SMILESCCOC(=O)CNc1cccc(O)c1
InChIInChI=1S/C10H13NO3/c1-2-14-10(13)7-11-8-4-3-5-9(12)6-8/h3-6,11-12H,2,7H2,1H3
InChIKeyCYQMEDLZDZYDKW-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.37
Rot. Bonds4

About ethyl 2-(3-hydroxyanilino)acetate

ethyl 2-(3-hydroxyanilino)acetate (PubChem CID 22630327) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is ethyl 2-(3-hydroxyanilino)acetate.

Molecular Properties

Compound Nameethyl 2-(3-hydroxyanilino)acetate
PubChem CID22630327
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Nameethyl 2-(3-hydroxyanilino)acetate
SMILESCCOC(=O)CNc1cccc(O)c1
InChIInChI=1S/C10H13NO3/c1-2-14-10(13)7-11-8-4-3-5-9(12)6-8/h3-6,11-12H,2,7H2,1H3
InChIKeyCYQMEDLZDZYDKW-UHFFFAOYSA-N
XLogP1.37
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-(3,5-dihydroxyanilino)acetate
CID 165356173
tert-butyl 2-(3-hydroxyanilino)acetate
CID 68777039
3-[(2-ethoxy-2-oxoethyl)amino]benzoate
CID 4063762
ethyl 2-(3,4-dihydroxyanilino)acetate
CID 22630378
diethyl 2-[(3-hydroxyanilino)methyl]propanedioate
CID 71327105
ethyl 2-(4-hydroxyanilino)acetate;hydrochloride
CID 68734163
ethyl 2-(3,4-dimethylanilino)acetate;hydrochloride
CID 163328951
2-(3-hydroxyanilino)acetohydrazide
CID 132888164
phenyl 3-[(2-ethoxy-2-oxoethyl)amino]benzoate
CID 20565565
ethyl 3-[(2-oxo-2-phenylmethoxyethyl)amino]benzoate
CID 162365695
3-(ethylamino)phenol
CID 578991
ethyl 2-[(3-hydroxyphenyl)sulfonylamino]acetate
CID 81258635

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(3-hydroxyanilino)acetate?
The IUPAC name of ethyl 2-(3-hydroxyanilino)acetate (CID 22630327) is ethyl 2-(3-hydroxyanilino)acetate.
What is the SMILES notation for ethyl 2-(3-hydroxyanilino)acetate?
The canonical SMILES for ethyl 2-(3-hydroxyanilino)acetate is CCOC(=O)CNc1cccc(O)c1.
What is the InChIKey of ethyl 2-(3-hydroxyanilino)acetate?
The InChIKey is CYQMEDLZDZYDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-2-14-10(13)7-11-8-4-3-5-9(12)6-8/h3-6,11-12H,2,7H2,1H3.
What are the key properties of ethyl 2-(3-hydroxyanilino)acetate?
ethyl 2-(3-hydroxyanilino)acetate has a molecular weight of 195.22 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(3-hydroxyanilino)acetate is sourced from PubChem (CID 22630327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).