4-fluoro-7-nitroquinolin-8-ol

C9H5FN2O3 — CID 166150161

IUPAC4-fluoro-7-nitroquinolin-8-ol
SMILESO=[N+]([O-])c1ccc2c(F)ccnc2c1O
InChIInChI=1S/C9H5FN2O3/c10-6-3-4-11-8-5(6)1-2-7(9(8)13)12(14)15/h1-4,13H
InChIKeySHPBOJANWLGQJZ-UHFFFAOYSA-N
MW208.15 g/mol
LogP1.99
Rot. Bonds1

About 4-fluoro-7-nitroquinolin-8-ol

4-fluoro-7-nitroquinolin-8-ol (PubChem CID 166150161) has the molecular formula C9H5FN2O3 and a molecular weight of 208.15 g/mol. Its IUPAC name is 4-fluoro-7-nitroquinolin-8-ol.

Molecular Properties

Compound Name4-fluoro-7-nitroquinolin-8-ol
PubChem CID166150161
Molecular FormulaC9H5FN2O3
Molecular Weight208.15 g/mol
Exact Mass208.03
IUPAC Name4-fluoro-7-nitroquinolin-8-ol
SMILESO=[N+]([O-])c1ccc2c(F)ccnc2c1O
InChIInChI=1S/C9H5FN2O3/c10-6-3-4-11-8-5(6)1-2-7(9(8)13)12(14)15/h1-4,13H
InChIKeySHPBOJANWLGQJZ-UHFFFAOYSA-N
XLogP1.99
TPSA76.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.15
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

7-nitro-4-phenylquinolin-8-ol
CID 166150148
4-imidazol-1-yl-7-nitroquinolin-8-ol
CID 166150167
4-morpholin-4-yl-7-nitroquinolin-8-ol
CID 166150251
5-(difluoromethyl)-7-nitroquinolin-8-ol
CID 171471368
5-fluoro-6-nitroquinoxaline
CID 164822939
3-fluoro-2,6-dinitronaphthalene-1,5-diol
CID 174974436
4-chloro-7-nitro-3-phenylquinolin-8-ol
CID 166150290
4-(2-methylpiperidin-1-yl)-7-nitroquinolin-8-ol
CID 167216788
4-fluoro-7-nitro-2H-benzotriazole
CID 123254608
7-bromo-5-nitroquinolin-8-ol
CID 14125599
5-fluoro-2-methoxy-8-nitroquinoline
CID 86241718
5-fluoro-8-nitroisoquinoline-1-carbonitrile
CID 82571543

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-7-nitroquinolin-8-ol?
The IUPAC name of 4-fluoro-7-nitroquinolin-8-ol (CID 166150161) is 4-fluoro-7-nitroquinolin-8-ol.
What is the SMILES notation for 4-fluoro-7-nitroquinolin-8-ol?
The canonical SMILES for 4-fluoro-7-nitroquinolin-8-ol is O=[N+]([O-])c1ccc2c(F)ccnc2c1O.
What is the InChIKey of 4-fluoro-7-nitroquinolin-8-ol?
The InChIKey is SHPBOJANWLGQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5FN2O3/c10-6-3-4-11-8-5(6)1-2-7(9(8)13)12(14)15/h1-4,13H.
What are the key properties of 4-fluoro-7-nitroquinolin-8-ol?
4-fluoro-7-nitroquinolin-8-ol has a molecular weight of 208.15 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-7-nitroquinolin-8-ol is sourced from PubChem (CID 166150161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).