8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline

C17H11FN4O — CID 154754655

IUPAC8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline
SMILESFc1cccc2c(Oc3ccc(-n4cccn4)cc3)ncnc12
InChIInChI=1S/C17H11FN4O/c18-15-4-1-3-14-16(15)19-11-20-17(14)23-13-7-5-12(6-8-13)22-10-2-9-21-22/h1-11H
InChIKeyGHXIBWRUIBENJN-UHFFFAOYSA-N
MW306.30 g/mol
LogP3.75
Rot. Bonds3

About 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline

8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline (PubChem CID 154754655) has the molecular formula C17H11FN4O and a molecular weight of 306.30 g/mol. Its IUPAC name is 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline.

Molecular Properties

Compound Name8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline
PubChem CID154754655
Molecular FormulaC17H11FN4O
Molecular Weight306.30 g/mol
Exact Mass306.09
IUPAC Name8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline
SMILESFc1cccc2c(Oc3ccc(-n4cccn4)cc3)ncnc12
InChIInChI=1S/C17H11FN4O/c18-15-4-1-3-14-16(15)19-11-20-17(14)23-13-7-5-12(6-8-13)22-10-2-9-21-22/h1-11H
InChIKeyGHXIBWRUIBENJN-UHFFFAOYSA-N
XLogP3.75
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.30
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline?
The IUPAC name of 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline (CID 154754655) is 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline.
What is the SMILES notation for 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline?
The canonical SMILES for 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline is Fc1cccc2c(Oc3ccc(-n4cccn4)cc3)ncnc12.
What is the InChIKey of 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline?
The InChIKey is GHXIBWRUIBENJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN4O/c18-15-4-1-3-14-16(15)19-11-20-17(14)23-13-7-5-12(6-8-13)22-10-2-9-21-22/h1-11H.
What are the key properties of 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline?
8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline has a molecular weight of 306.30 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-4-(4-pyrazol-1-ylphenoxy)quinazoline is sourced from PubChem (CID 154754655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).