(2R,3R)-2,3-dihydro-1H-indole-2,3-diol

C8H9NO2 — CID 25200922

IUPAC(2R,3R)-2,3-dihydro-1H-indole-2,3-diol
SMILESO[C@@H]1c2ccccc2N[C@@H]1O
InChIInChI=1S/C8H9NO2/c10-7-5-3-1-2-4-6(5)9-8(7)11/h1-4,7-11H/t7-,8-/m1/s1
InChIKeyMLCFNGQWWKZFBD-HTQZYQBOSA-N
MW151.16 g/mol
LogP0.46
Rot. Bonds

About (2R,3R)-2,3-dihydro-1H-indole-2,3-diol

(2R,3R)-2,3-dihydro-1H-indole-2,3-diol (PubChem CID 25200922) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is (2R,3R)-2,3-dihydro-1H-indole-2,3-diol.

Molecular Properties

Compound Name(2R,3R)-2,3-dihydro-1H-indole-2,3-diol
PubChem CID25200922
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name(2R,3R)-2,3-dihydro-1H-indole-2,3-diol
SMILESO[C@@H]1c2ccccc2N[C@@H]1O
InChIInChI=1S/C8H9NO2/c10-7-5-3-1-2-4-6(5)9-8(7)11/h1-4,7-11H/t7-,8-/m1/s1
InChIKeyMLCFNGQWWKZFBD-HTQZYQBOSA-N
XLogP0.46
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-dihydro-1H-indole-2,3-diol?
The IUPAC name of (2R,3R)-2,3-dihydro-1H-indole-2,3-diol (CID 25200922) is (2R,3R)-2,3-dihydro-1H-indole-2,3-diol.
What is the SMILES notation for (2R,3R)-2,3-dihydro-1H-indole-2,3-diol?
The canonical SMILES for (2R,3R)-2,3-dihydro-1H-indole-2,3-diol is O[C@@H]1c2ccccc2N[C@@H]1O.
What is the InChIKey of (2R,3R)-2,3-dihydro-1H-indole-2,3-diol?
The InChIKey is MLCFNGQWWKZFBD-HTQZYQBOSA-N. The full InChI is InChI=1S/C8H9NO2/c10-7-5-3-1-2-4-6(5)9-8(7)11/h1-4,7-11H/t7-,8-/m1/s1.
What are the key properties of (2R,3R)-2,3-dihydro-1H-indole-2,3-diol?
(2R,3R)-2,3-dihydro-1H-indole-2,3-diol has a molecular weight of 151.16 g/mol, XLogP of 0.46, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-dihydro-1H-indole-2,3-diol is sourced from PubChem (CID 25200922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).