2-hydroxy-2-(1H-indol-2-yl)acetate

C10H8NO3- — CID 19833059

IUPAC2-hydroxy-2-(1H-indol-2-yl)acetate
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)/p-1
InChIKeyQWODYJJYRKWTHA-UHFFFAOYSA-M
MW190.18 g/mol
LogP-0.05
Rot. Bonds2

About 2-hydroxy-2-(1H-indol-2-yl)acetate

2-hydroxy-2-(1H-indol-2-yl)acetate (PubChem CID 19833059) has the molecular formula C10H8NO3- and a molecular weight of 190.18 g/mol. Its IUPAC name is 2-hydroxy-2-(1H-indol-2-yl)acetate.

Molecular Properties

Compound Name2-hydroxy-2-(1H-indol-2-yl)acetate
PubChem CID19833059
Molecular FormulaC10H8NO3-
Molecular Weight190.18 g/mol
Exact Mass190.05
IUPAC Name2-hydroxy-2-(1H-indol-2-yl)acetate
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)/p-1
InChIKeyQWODYJJYRKWTHA-UHFFFAOYSA-M
XLogP-0.05
TPSA76.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.18
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-2-(1H-indol-2-yl)acetamide
CID 173051897
1-(1H-indol-2-yl)-2-methylpropan-1-ol
CID 91442586
2-hydroxy-2-(1H-indol-2-yl)acetonitrile
CID 84654386
1-(1H-indol-2-yl)prop-2-yn-1-ol
CID 172559122
2-amino-1-(1H-indol-2-yl)ethanol
CID 82599143
2-azaniumyl-3-(1H-indol-2-yl)propanoate
CID 23278059
(3S)-3-(1H-indol-2-yl)butanoic acid
CID 96762182
1H-indol-2-yl-(2-nitrophenyl)methanol
CID 71725879
2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol
CID 175731696
(1R)-3-amino-1-(1H-indol-2-yl)propan-1-ol
CID 96625080
2-(1H-indol-2-yl)propanal
CID 88965178
2-(1-methylsulfonylethyl)-1H-indole
CID 173051925

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-(1H-indol-2-yl)acetate?
The IUPAC name of 2-hydroxy-2-(1H-indol-2-yl)acetate (CID 19833059) is 2-hydroxy-2-(1H-indol-2-yl)acetate.
What is the SMILES notation for 2-hydroxy-2-(1H-indol-2-yl)acetate?
The canonical SMILES for 2-hydroxy-2-(1H-indol-2-yl)acetate is O=C([O-])C(O)c1cc2ccccc2[nH]1.
What is the InChIKey of 2-hydroxy-2-(1H-indol-2-yl)acetate?
The InChIKey is QWODYJJYRKWTHA-UHFFFAOYSA-M. 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)/p-1.
What are the key properties of 2-hydroxy-2-(1H-indol-2-yl)acetate?
2-hydroxy-2-(1H-indol-2-yl)acetate has a molecular weight of 190.18 g/mol, XLogP of -0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-(1H-indol-2-yl)acetate is sourced from PubChem (CID 19833059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).