(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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Related Compounds

2,3-dihydro-1H-indol-2-ylmethanol
CID 2794664
1-Phenyl-2-(phenylamino)ethan-1-ol
CID 12434801
(-)-3a-Hydroxyfuroindoline
CID 11355813
2,3,4,5-tetrahydro-1H-1-benzazepin-5-ol
CID 18378645
(1S)-1-phenyl-2-(phenylamino)ethan-1-ol
CID 39243263
2-Hydroxyindoline
CID 13879745
(1R)-2-anilino-1-phenylethanol
CID 34003102
(2-(Benzylamino)phenyl)methanol
CID 296053
(S)-(+)-2-Indolinemethanol
CID 6951186
(2,3-dihydro-1H-indol-4-yl)methanol
CID 11389477
(2,3-dihydro-1H-indol-6-yl)methanol
CID 20666213
(Indolin-3-yl)methanol
CID 22392033

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).