indol-2-one;phenol

C14H11NO2 — CID 175483332

IUPACindol-2-one;phenol
SMILESO=C1C=c2ccccc2=N1.Oc1ccccc1
InChIInChI=1S/C8H5NO.C6H6O/c10-8-5-6-3-1-2-4-7(6)9-8;7-6-4-2-1-3-5-6/h1-5H;1-5,7H
InChIKeyXCOPLOCUURRKTR-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.02
Rot. Bonds

About indol-2-one;phenol

indol-2-one;phenol (PubChem CID 175483332) has the molecular formula C14H11NO2 and a molecular weight of 225.25 g/mol. Its IUPAC name is indol-2-one;phenol.

Molecular Properties

Compound Nameindol-2-one;phenol
PubChem CID175483332
Molecular FormulaC14H11NO2
Molecular Weight225.25 g/mol
Exact Mass225.08
IUPAC Nameindol-2-one;phenol
SMILESO=C1C=c2ccccc2=N1.Oc1ccccc1
InChIInChI=1S/C8H5NO.C6H6O/c10-8-5-6-3-1-2-4-7(6)9-8;7-6-4-2-1-3-5-6/h1-5H;1-5,7H
InChIKeyXCOPLOCUURRKTR-UHFFFAOYSA-N
XLogP1.02
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of indol-2-one;phenol?
The IUPAC name of indol-2-one;phenol (CID 175483332) is indol-2-one;phenol.
What is the SMILES notation for indol-2-one;phenol?
The canonical SMILES for indol-2-one;phenol is O=C1C=c2ccccc2=N1.Oc1ccccc1.
What is the InChIKey of indol-2-one;phenol?
The InChIKey is XCOPLOCUURRKTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5NO.C6H6O/c10-8-5-6-3-1-2-4-7(6)9-8;7-6-4-2-1-3-5-6/h1-5H;1-5,7H.
What are the key properties of indol-2-one;phenol?
indol-2-one;phenol has a molecular weight of 225.25 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for indol-2-one;phenol is sourced from PubChem (CID 175483332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).