7-hydroxyindol-2-one

C8H5NO2 — CID 54408073

IUPAC7-hydroxyindol-2-one
SMILESO=C1C=c2cccc(O)c2=N1
InChIInChI=1S/C8H5NO2/c10-6-3-1-2-5-4-7(11)9-8(5)6/h1-4,10H
InChIKeyVSDZNKUXRNOJNL-UHFFFAOYSA-N
MW147.13 g/mol
LogP-0.67
Rot. Bonds

About 7-hydroxyindol-2-one

7-hydroxyindol-2-one (PubChem CID 54408073) has the molecular formula C8H5NO2 and a molecular weight of 147.13 g/mol. Its IUPAC name is 7-hydroxyindol-2-one.

Molecular Properties

Compound Name7-hydroxyindol-2-one
PubChem CID54408073
Molecular FormulaC8H5NO2
Molecular Weight147.13 g/mol
Exact Mass147.03
IUPAC Name7-hydroxyindol-2-one
SMILESO=C1C=c2cccc(O)c2=N1
InChIInChI=1S/C8H5NO2/c10-6-3-1-2-5-4-7(11)9-8(5)6/h1-4,10H
InChIKeyVSDZNKUXRNOJNL-UHFFFAOYSA-N
XLogP-0.67
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.13
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Hydroxy indole2-one
CID 19068933
2,6-Indolequinone
CID 136652242
7-(Trifluoromethoxy)indol-2-one
CID 172702956
5,7-Dihydroxy-2-indolone
CID 129709676
2-(2-Oxoindol-6-yl)acetic acid
CID 53827360
8-hydroxy-3H-quinolin-2-one
CID 67233698
Indol-2-one;hydrate
CID 90093449
8-hydroxy-6H-quinolin-2-one
CID 90789129
4-Hydroxyindol-2-one
CID 140641372
6-Hydroxy-7-methoxyindol-2-one
CID 174840087
4-Hydroxy-3-methylindol-2-one
CID 175302874
4-hydroxy-4aH-quinolin-2-one
CID 71303372

Frequently Asked Questions

What is the IUPAC name of 7-hydroxyindol-2-one?
The IUPAC name of 7-hydroxyindol-2-one (CID 54408073) is 7-hydroxyindol-2-one.
What is the SMILES notation for 7-hydroxyindol-2-one?
The canonical SMILES for 7-hydroxyindol-2-one is O=C1C=c2cccc(O)c2=N1.
What is the InChIKey of 7-hydroxyindol-2-one?
The InChIKey is VSDZNKUXRNOJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NO2/c10-6-3-1-2-5-4-7(11)9-8(5)6/h1-4,10H.
What are the key properties of 7-hydroxyindol-2-one?
7-hydroxyindol-2-one has a molecular weight of 147.13 g/mol, XLogP of -0.67, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxyindol-2-one is sourced from PubChem (CID 54408073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).