4-phenoxy-2-(trifluoromethyl)quinazoline

C15H9F3N2O — CID 1475452

IUPAC4-phenoxy-2-(trifluoromethyl)quinazoline
SMILESFC(F)(F)c1nc(Oc2ccccc2)c2ccccc2n1
InChIInChI=1S/C15H9F3N2O/c16-15(17,18)14-19-12-9-5-4-8-11(12)13(20-14)21-10-6-2-1-3-7-10/h1-9H
InChIKeyHYATXJUKRNTWHG-UHFFFAOYSA-N
MW290.24 g/mol
LogP4.44
Rot. Bonds2

About 4-phenoxy-2-(trifluoromethyl)quinazoline

4-phenoxy-2-(trifluoromethyl)quinazoline (PubChem CID 1475452) has the molecular formula C15H9F3N2O and a molecular weight of 290.24 g/mol. Its IUPAC name is 4-phenoxy-2-(trifluoromethyl)quinazoline.

Molecular Properties

Compound Name4-phenoxy-2-(trifluoromethyl)quinazoline
PubChem CID1475452
Molecular FormulaC15H9F3N2O
Molecular Weight290.24 g/mol
Exact Mass290.07
IUPAC Name4-phenoxy-2-(trifluoromethyl)quinazoline
SMILESFC(F)(F)c1nc(Oc2ccccc2)c2ccccc2n1
InChIInChI=1S/C15H9F3N2O/c16-15(17,18)14-19-12-9-5-4-8-11(12)13(20-14)21-10-6-2-1-3-7-10/h1-9H
InChIKeyHYATXJUKRNTWHG-UHFFFAOYSA-N
XLogP4.44
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.24
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-phenoxy-2-(trifluoromethyl)quinazoline?
The IUPAC name of 4-phenoxy-2-(trifluoromethyl)quinazoline (CID 1475452) is 4-phenoxy-2-(trifluoromethyl)quinazoline.
What is the SMILES notation for 4-phenoxy-2-(trifluoromethyl)quinazoline?
The canonical SMILES for 4-phenoxy-2-(trifluoromethyl)quinazoline is FC(F)(F)c1nc(Oc2ccccc2)c2ccccc2n1.
What is the InChIKey of 4-phenoxy-2-(trifluoromethyl)quinazoline?
The InChIKey is HYATXJUKRNTWHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9F3N2O/c16-15(17,18)14-19-12-9-5-4-8-11(12)13(20-14)21-10-6-2-1-3-7-10/h1-9H.
What are the key properties of 4-phenoxy-2-(trifluoromethyl)quinazoline?
4-phenoxy-2-(trifluoromethyl)quinazoline has a molecular weight of 290.24 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenoxy-2-(trifluoromethyl)quinazoline is sourced from PubChem (CID 1475452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).