2-[2-(4-fluorophenyl)ethoxy]quinazoline

C16H13FN2O — CID 23196541

IUPAC2-[2-(4-fluorophenyl)ethoxy]quinazoline
SMILESFc1ccc(CCOc2ncc3ccccc3n2)cc1
InChIInChI=1S/C16H13FN2O/c17-14-7-5-12(6-8-14)9-10-20-16-18-11-13-3-1-2-4-15(13)19-16/h1-8,11H,9-10H2
InChIKeyWVQUBAAWTLQGNZ-UHFFFAOYSA-N
MW268.29 g/mol
LogP3.39
Rot. Bonds4

About 2-[2-(4-fluorophenyl)ethoxy]quinazoline

2-[2-(4-fluorophenyl)ethoxy]quinazoline (PubChem CID 23196541) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)ethoxy]quinazoline.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)ethoxy]quinazoline
PubChem CID23196541
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC Name2-[2-(4-fluorophenyl)ethoxy]quinazoline
SMILESFc1ccc(CCOc2ncc3ccccc3n2)cc1
InChIInChI=1S/C16H13FN2O/c17-14-7-5-12(6-8-14)9-10-20-16-18-11-13-3-1-2-4-15(13)19-16/h1-8,11H,9-10H2
InChIKeyWVQUBAAWTLQGNZ-UHFFFAOYSA-N
XLogP3.39
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)ethoxy]quinazoline?
The IUPAC name of 2-[2-(4-fluorophenyl)ethoxy]quinazoline (CID 23196541) is 2-[2-(4-fluorophenyl)ethoxy]quinazoline.
What is the SMILES notation for 2-[2-(4-fluorophenyl)ethoxy]quinazoline?
The canonical SMILES for 2-[2-(4-fluorophenyl)ethoxy]quinazoline is Fc1ccc(CCOc2ncc3ccccc3n2)cc1.
What is the InChIKey of 2-[2-(4-fluorophenyl)ethoxy]quinazoline?
The InChIKey is WVQUBAAWTLQGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c17-14-7-5-12(6-8-14)9-10-20-16-18-11-13-3-1-2-4-15(13)19-16/h1-8,11H,9-10H2.
What are the key properties of 2-[2-(4-fluorophenyl)ethoxy]quinazoline?
2-[2-(4-fluorophenyl)ethoxy]quinazoline has a molecular weight of 268.29 g/mol, XLogP of 3.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)ethoxy]quinazoline is sourced from PubChem (CID 23196541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).