5-fluoro-3-nitroso-1H-indol-2-ol

C8H5FN2O2 — CID 822594

IUPAC5-fluoro-3-nitroso-1H-indol-2-ol
SMILESO=Nc1c(O)[nH]c2ccc(F)cc12
InChIInChI=1S/C8H5FN2O2/c9-4-1-2-6-5(3-4)7(11-13)8(12)10-6/h1-3,10,12H
InChIKeyZGKIRHDGQBKXKT-UHFFFAOYSA-N
MW180.14 g/mol
LogP2.41
Rot. Bonds1

About 5-fluoro-3-nitroso-1H-indol-2-ol

5-fluoro-3-nitroso-1H-indol-2-ol (PubChem CID 822594) has the molecular formula C8H5FN2O2 and a molecular weight of 180.14 g/mol. Its IUPAC name is 5-fluoro-3-nitroso-1H-indol-2-ol.

Molecular Properties

Compound Name5-fluoro-3-nitroso-1H-indol-2-ol
PubChem CID822594
Molecular FormulaC8H5FN2O2
Molecular Weight180.14 g/mol
Exact Mass180.03
IUPAC Name5-fluoro-3-nitroso-1H-indol-2-ol
SMILESO=Nc1c(O)[nH]c2ccc(F)cc12
InChIInChI=1S/C8H5FN2O2/c9-4-1-2-6-5(3-4)7(11-13)8(12)10-6/h1-3,10,12H
InChIKeyZGKIRHDGQBKXKT-UHFFFAOYSA-N
XLogP2.41
TPSA65.45 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.14
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-nitroso-1H-indol-2-ol?
The IUPAC name of 5-fluoro-3-nitroso-1H-indol-2-ol (CID 822594) is 5-fluoro-3-nitroso-1H-indol-2-ol.
What is the SMILES notation for 5-fluoro-3-nitroso-1H-indol-2-ol?
The canonical SMILES for 5-fluoro-3-nitroso-1H-indol-2-ol is O=Nc1c(O)[nH]c2ccc(F)cc12.
What is the InChIKey of 5-fluoro-3-nitroso-1H-indol-2-ol?
The InChIKey is ZGKIRHDGQBKXKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2O2/c9-4-1-2-6-5(3-4)7(11-13)8(12)10-6/h1-3,10,12H.
What are the key properties of 5-fluoro-3-nitroso-1H-indol-2-ol?
5-fluoro-3-nitroso-1H-indol-2-ol has a molecular weight of 180.14 g/mol, XLogP of 2.41, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-nitroso-1H-indol-2-ol is sourced from PubChem (CID 822594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).