7-fluoro-1,4-dihydroquinazolin-4-ol

C8H7FN2O — CID 163647227

IUPAC7-fluoro-1,4-dihydroquinazolin-4-ol
SMILESOC1N=CNc2cc(F)ccc21
InChIInChI=1S/C8H7FN2O/c9-5-1-2-6-7(3-5)10-4-11-8(6)12/h1-4,8,12H,(H,10,11)
InChIKeyIJGLZSIHCAOGMD-UHFFFAOYSA-N
MW166.15 g/mol
LogP1.27
Rot. Bonds

About 7-fluoro-1,4-dihydroquinazolin-4-ol

7-fluoro-1,4-dihydroquinazolin-4-ol (PubChem CID 163647227) has the molecular formula C8H7FN2O and a molecular weight of 166.15 g/mol. Its IUPAC name is 7-fluoro-1,4-dihydroquinazolin-4-ol.

Molecular Properties

Compound Name7-fluoro-1,4-dihydroquinazolin-4-ol
PubChem CID163647227
Molecular FormulaC8H7FN2O
Molecular Weight166.15 g/mol
Exact Mass166.05
IUPAC Name7-fluoro-1,4-dihydroquinazolin-4-ol
SMILESOC1N=CNc2cc(F)ccc21
InChIInChI=1S/C8H7FN2O/c9-5-1-2-6-7(3-5)10-4-11-8(6)12/h1-4,8,12H,(H,10,11)
InChIKeyIJGLZSIHCAOGMD-UHFFFAOYSA-N
XLogP1.27
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.15
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1,4-dihydroquinazolin-4-ol?
The IUPAC name of 7-fluoro-1,4-dihydroquinazolin-4-ol (CID 163647227) is 7-fluoro-1,4-dihydroquinazolin-4-ol.
What is the SMILES notation for 7-fluoro-1,4-dihydroquinazolin-4-ol?
The canonical SMILES for 7-fluoro-1,4-dihydroquinazolin-4-ol is OC1N=CNc2cc(F)ccc21.
What is the InChIKey of 7-fluoro-1,4-dihydroquinazolin-4-ol?
The InChIKey is IJGLZSIHCAOGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN2O/c9-5-1-2-6-7(3-5)10-4-11-8(6)12/h1-4,8,12H,(H,10,11).
What are the key properties of 7-fluoro-1,4-dihydroquinazolin-4-ol?
7-fluoro-1,4-dihydroquinazolin-4-ol has a molecular weight of 166.15 g/mol, XLogP of 1.27, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1,4-dihydroquinazolin-4-ol is sourced from PubChem (CID 163647227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).