4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline

C19H12FN3O — CID 930135

IUPAC4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline
SMILESFc1ccccc1Oc1nc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C19H12FN3O/c20-15-6-2-4-8-17(15)24-19-14-5-1-3-7-16(14)22-18(23-19)13-9-11-21-12-10-13/h1-12H
InChIKeyLXTKFDCEIMORFQ-UHFFFAOYSA-N
MW317.32 g/mol
LogP4.62
Rot. Bonds3

About 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline

4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline (PubChem CID 930135) has the molecular formula C19H12FN3O and a molecular weight of 317.32 g/mol. Its IUPAC name is 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline.

Molecular Properties

Compound Name4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline
PubChem CID930135
Molecular FormulaC19H12FN3O
Molecular Weight317.32 g/mol
Exact Mass317.10
IUPAC Name4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline
SMILESFc1ccccc1Oc1nc(-c2ccncc2)nc2ccccc12
InChIInChI=1S/C19H12FN3O/c20-15-6-2-4-8-17(15)24-19-14-5-1-3-7-16(14)22-18(23-19)13-9-11-21-12-10-13/h1-12H
InChIKeyLXTKFDCEIMORFQ-UHFFFAOYSA-N
XLogP4.62
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.32
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline?
The IUPAC name of 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline (CID 930135) is 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline.
What is the SMILES notation for 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline?
The canonical SMILES for 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline is Fc1ccccc1Oc1nc(-c2ccncc2)nc2ccccc12.
What is the InChIKey of 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline?
The InChIKey is LXTKFDCEIMORFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN3O/c20-15-6-2-4-8-17(15)24-19-14-5-1-3-7-16(14)22-18(23-19)13-9-11-21-12-10-13/h1-12H.
What are the key properties of 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline?
4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline has a molecular weight of 317.32 g/mol, XLogP of 4.62, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenoxy)-2-pyridin-4-ylquinazoline is sourced from PubChem (CID 930135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).