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

C8H5FN2O2 — CID 750687

IUPAC7-fluoro-3-nitroso-1H-indol-2-ol
SMILESO=Nc1c(O)[nH]c2c(F)cccc12
InChIInChI=1S/C8H5FN2O2/c9-5-3-1-2-4-6(5)10-8(12)7(4)11-13/h1-3,10,12H
InChIKeyOCGNSRRMJCCGCE-UHFFFAOYSA-N
MW180.14 g/mol
LogP2.41
Rot. Bonds1

About 7-fluoro-3-nitroso-1H-indol-2-ol

7-fluoro-3-nitroso-1H-indol-2-ol (PubChem CID 750687) has the molecular formula C8H5FN2O2 and a molecular weight of 180.14 g/mol. Its IUPAC name is 7-fluoro-3-nitroso-1H-indol-2-ol.

Molecular Properties

Compound Name7-fluoro-3-nitroso-1H-indol-2-ol
PubChem CID750687
Molecular FormulaC8H5FN2O2
Molecular Weight180.14 g/mol
Exact Mass180.03
IUPAC Name7-fluoro-3-nitroso-1H-indol-2-ol
SMILESO=Nc1c(O)[nH]c2c(F)cccc12
InChIInChI=1S/C8H5FN2O2/c9-5-3-1-2-4-6(5)10-8(12)7(4)11-13/h1-3,10,12H
InChIKeyOCGNSRRMJCCGCE-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 7-fluoro-3-nitroso-1H-indol-2-ol?
The IUPAC name of 7-fluoro-3-nitroso-1H-indol-2-ol (CID 750687) is 7-fluoro-3-nitroso-1H-indol-2-ol.
What is the SMILES notation for 7-fluoro-3-nitroso-1H-indol-2-ol?
The canonical SMILES for 7-fluoro-3-nitroso-1H-indol-2-ol is O=Nc1c(O)[nH]c2c(F)cccc12.
What is the InChIKey of 7-fluoro-3-nitroso-1H-indol-2-ol?
The InChIKey is OCGNSRRMJCCGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2O2/c9-5-3-1-2-4-6(5)10-8(12)7(4)11-13/h1-3,10,12H.
What are the key properties of 7-fluoro-3-nitroso-1H-indol-2-ol?
7-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 7-fluoro-3-nitroso-1H-indol-2-ol is sourced from PubChem (CID 750687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).