2-(N-(4-hydroxyphenyl)anilino)acetic acid

C14H13NO3 — CID 138066877

IUPAC2-(N-(4-hydroxyphenyl)anilino)acetic acid
SMILESO=C(O)CN(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C14H13NO3/c16-13-8-6-12(7-9-13)15(10-14(17)18)11-4-2-1-3-5-11/h1-9,16H,10H2,(H,17,18)
InChIKeyXTQZWIYPBKRHGH-UHFFFAOYSA-N
MW243.26 g/mol
LogP2.61
Rot. Bonds4

About 2-(N-(4-hydroxyphenyl)anilino)acetic acid

2-(N-(4-hydroxyphenyl)anilino)acetic acid (PubChem CID 138066877) has the molecular formula C14H13NO3 and a molecular weight of 243.26 g/mol. Its IUPAC name is 2-(N-(4-hydroxyphenyl)anilino)acetic acid.

Molecular Properties

Compound Name2-(N-(4-hydroxyphenyl)anilino)acetic acid
PubChem CID138066877
Molecular FormulaC14H13NO3
Molecular Weight243.26 g/mol
Exact Mass243.09
IUPAC Name2-(N-(4-hydroxyphenyl)anilino)acetic acid
SMILESO=C(O)CN(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C14H13NO3/c16-13-8-6-12(7-9-13)15(10-14(17)18)11-4-2-1-3-5-11/h1-9,16H,10H2,(H,17,18)
InChIKeyXTQZWIYPBKRHGH-UHFFFAOYSA-N
XLogP2.61
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.26
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(N-(4-hydroxyphenyl)anilino)acetic acid?
The IUPAC name of 2-(N-(4-hydroxyphenyl)anilino)acetic acid (CID 138066877) is 2-(N-(4-hydroxyphenyl)anilino)acetic acid.
What is the SMILES notation for 2-(N-(4-hydroxyphenyl)anilino)acetic acid?
The canonical SMILES for 2-(N-(4-hydroxyphenyl)anilino)acetic acid is O=C(O)CN(c1ccccc1)c1ccc(O)cc1.
What is the InChIKey of 2-(N-(4-hydroxyphenyl)anilino)acetic acid?
The InChIKey is XTQZWIYPBKRHGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO3/c16-13-8-6-12(7-9-13)15(10-14(17)18)11-4-2-1-3-5-11/h1-9,16H,10H2,(H,17,18).
What are the key properties of 2-(N-(4-hydroxyphenyl)anilino)acetic acid?
2-(N-(4-hydroxyphenyl)anilino)acetic acid has a molecular weight of 243.26 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-(4-hydroxyphenyl)anilino)acetic acid is sourced from PubChem (CID 138066877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).