6-hydroxy-1,3-dimethyl-3H-indol-2-one

C10H11NO2 — CID 19692931

IUPAC6-hydroxy-1,3-dimethyl-3H-indol-2-one
SMILESCC1C(=O)N(C)c2cc(O)ccc21
InChIInChI=1S/C10H11NO2/c1-6-8-4-3-7(12)5-9(8)11(2)10(6)13/h3-6,12H,1-2H3
InChIKeyYNEVJVGTIHNFEP-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.47
Rot. Bonds

About 6-hydroxy-1,3-dimethyl-3H-indol-2-one

6-hydroxy-1,3-dimethyl-3H-indol-2-one (PubChem CID 19692931) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 6-hydroxy-1,3-dimethyl-3H-indol-2-one.

Molecular Properties

Compound Name6-hydroxy-1,3-dimethyl-3H-indol-2-one
PubChem CID19692931
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name6-hydroxy-1,3-dimethyl-3H-indol-2-one
SMILESCC1C(=O)N(C)c2cc(O)ccc21
InChIInChI=1S/C10H11NO2/c1-6-8-4-3-7(12)5-9(8)11(2)10(6)13/h3-6,12H,1-2H3
InChIKeyYNEVJVGTIHNFEP-UHFFFAOYSA-N
XLogP1.47
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1,3-dimethyl-3H-indol-2-one?
The IUPAC name of 6-hydroxy-1,3-dimethyl-3H-indol-2-one (CID 19692931) is 6-hydroxy-1,3-dimethyl-3H-indol-2-one.
What is the SMILES notation for 6-hydroxy-1,3-dimethyl-3H-indol-2-one?
The canonical SMILES for 6-hydroxy-1,3-dimethyl-3H-indol-2-one is CC1C(=O)N(C)c2cc(O)ccc21.
What is the InChIKey of 6-hydroxy-1,3-dimethyl-3H-indol-2-one?
The InChIKey is YNEVJVGTIHNFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-6-8-4-3-7(12)5-9(8)11(2)10(6)13/h3-6,12H,1-2H3.
What are the key properties of 6-hydroxy-1,3-dimethyl-3H-indol-2-one?
6-hydroxy-1,3-dimethyl-3H-indol-2-one has a molecular weight of 177.20 g/mol, XLogP of 1.47, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1,3-dimethyl-3H-indol-2-one is sourced from PubChem (CID 19692931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).