4-phenoxy-2-pyridin-3-ylquinazoline

C19H13N3O — CID 872375

IUPAC4-phenoxy-2-pyridin-3-ylquinazoline
SMILESc1ccc(Oc2nc(-c3cccnc3)nc3ccccc23)cc1
InChIInChI=1S/C19H13N3O/c1-2-8-15(9-3-1)23-19-16-10-4-5-11-17(16)21-18(22-19)14-7-6-12-20-13-14/h1-13H
InChIKeyZOJJIYUGSQDYFD-UHFFFAOYSA-N
MW299.33 g/mol
LogP4.48
Rot. Bonds3

About 4-phenoxy-2-pyridin-3-ylquinazoline

4-phenoxy-2-pyridin-3-ylquinazoline (PubChem CID 872375) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 4-phenoxy-2-pyridin-3-ylquinazoline.

Molecular Properties

Compound Name4-phenoxy-2-pyridin-3-ylquinazoline
PubChem CID872375
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name4-phenoxy-2-pyridin-3-ylquinazoline
SMILESc1ccc(Oc2nc(-c3cccnc3)nc3ccccc23)cc1
InChIInChI=1S/C19H13N3O/c1-2-8-15(9-3-1)23-19-16-10-4-5-11-17(16)21-18(22-19)14-7-6-12-20-13-14/h1-13H
InChIKeyZOJJIYUGSQDYFD-UHFFFAOYSA-N
XLogP4.48
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-phenoxy-2-pyridin-3-ylquinazoline?
The IUPAC name of 4-phenoxy-2-pyridin-3-ylquinazoline (CID 872375) is 4-phenoxy-2-pyridin-3-ylquinazoline.
What is the SMILES notation for 4-phenoxy-2-pyridin-3-ylquinazoline?
The canonical SMILES for 4-phenoxy-2-pyridin-3-ylquinazoline is c1ccc(Oc2nc(-c3cccnc3)nc3ccccc23)cc1.
What is the InChIKey of 4-phenoxy-2-pyridin-3-ylquinazoline?
The InChIKey is ZOJJIYUGSQDYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c1-2-8-15(9-3-1)23-19-16-10-4-5-11-17(16)21-18(22-19)14-7-6-12-20-13-14/h1-13H.
What are the key properties of 4-phenoxy-2-pyridin-3-ylquinazoline?
4-phenoxy-2-pyridin-3-ylquinazoline has a molecular weight of 299.33 g/mol, XLogP of 4.48, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenoxy-2-pyridin-3-ylquinazoline is sourced from PubChem (CID 872375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).