2-hydroxy-2-(1H-indol-2-yl)acetic acid

C10H9NO3 — CID 19833060

IUPAC2-hydroxy-2-(1H-indol-2-yl)acetic acid
SMILESO=C(O)C(O)c1cc2ccccc2[nH]1
InChIInChI=1S/C10H9NO3/c12-9(10(13)14)8-5-6-3-1-2-4-7(6)11-8/h1-5,9,11-12H,(H,13,14)
InChIKeyQWODYJJYRKWTHA-UHFFFAOYSA-N
MW191.19 g/mol
LogP1.29
Rot. Bonds2

About 2-hydroxy-2-(1H-indol-2-yl)acetic acid

2-hydroxy-2-(1H-indol-2-yl)acetic acid (PubChem CID 19833060) has the molecular formula C10H9NO3 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-hydroxy-2-(1H-indol-2-yl)acetic acid.

Molecular Properties

Compound Name2-hydroxy-2-(1H-indol-2-yl)acetic acid
PubChem CID19833060
Molecular FormulaC10H9NO3
Molecular Weight191.19 g/mol
Exact Mass191.06
IUPAC Name2-hydroxy-2-(1H-indol-2-yl)acetic acid
SMILESO=C(O)C(O)c1cc2ccccc2[nH]1
InChIInChI=1S/C10H9NO3/c12-9(10(13)14)8-5-6-3-1-2-4-7(6)11-8/h1-5,9,11-12H,(H,13,14)
InChIKeyQWODYJJYRKWTHA-UHFFFAOYSA-N
XLogP1.29
TPSA73.32 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-(1H-indol-2-yl)acetic acid?
The IUPAC name of 2-hydroxy-2-(1H-indol-2-yl)acetic acid (CID 19833060) is 2-hydroxy-2-(1H-indol-2-yl)acetic acid.
What is the SMILES notation for 2-hydroxy-2-(1H-indol-2-yl)acetic acid?
The canonical SMILES for 2-hydroxy-2-(1H-indol-2-yl)acetic acid is O=C(O)C(O)c1cc2ccccc2[nH]1.
What is the InChIKey of 2-hydroxy-2-(1H-indol-2-yl)acetic acid?
The InChIKey is QWODYJJYRKWTHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO3/c12-9(10(13)14)8-5-6-3-1-2-4-7(6)11-8/h1-5,9,11-12H,(H,13,14).
What are the key properties of 2-hydroxy-2-(1H-indol-2-yl)acetic acid?
2-hydroxy-2-(1H-indol-2-yl)acetic acid has a molecular weight of 191.19 g/mol, XLogP of 1.29, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-(1H-indol-2-yl)acetic acid is sourced from PubChem (CID 19833060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).