4-(1-phenylethoxy)quinazolin-7-amine

C16H15N3O — CID 65336469

IUPAC4-(1-phenylethoxy)quinazolin-7-amine
SMILESCC(Oc1ncnc2cc(N)ccc12)c1ccccc1
InChIInChI=1S/C16H15N3O/c1-11(12-5-3-2-4-6-12)20-16-14-8-7-13(17)9-15(14)18-10-19-16/h2-11H,17H2,1H3
InChIKeyXOPDCJLNFMIJBZ-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.35
Rot. Bonds3

About 4-(1-phenylethoxy)quinazolin-7-amine

4-(1-phenylethoxy)quinazolin-7-amine (PubChem CID 65336469) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-(1-phenylethoxy)quinazolin-7-amine.

Molecular Properties

Compound Name4-(1-phenylethoxy)quinazolin-7-amine
PubChem CID65336469
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name4-(1-phenylethoxy)quinazolin-7-amine
SMILESCC(Oc1ncnc2cc(N)ccc12)c1ccccc1
InChIInChI=1S/C16H15N3O/c1-11(12-5-3-2-4-6-12)20-16-14-8-7-13(17)9-15(14)18-10-19-16/h2-11H,17H2,1H3
InChIKeyXOPDCJLNFMIJBZ-UHFFFAOYSA-N
XLogP3.35
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 4-(1-phenylethoxy)quinazolin-7-amine 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 4-(1-phenylethoxy)quinazolin-7-amine?
The IUPAC name of 4-(1-phenylethoxy)quinazolin-7-amine (CID 65336469) is 4-(1-phenylethoxy)quinazolin-7-amine.
What is the SMILES notation for 4-(1-phenylethoxy)quinazolin-7-amine?
The canonical SMILES for 4-(1-phenylethoxy)quinazolin-7-amine is CC(Oc1ncnc2cc(N)ccc12)c1ccccc1.
What is the InChIKey of 4-(1-phenylethoxy)quinazolin-7-amine?
The InChIKey is XOPDCJLNFMIJBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-11(12-5-3-2-4-6-12)20-16-14-8-7-13(17)9-15(14)18-10-19-16/h2-11H,17H2,1H3.
What are the key properties of 4-(1-phenylethoxy)quinazolin-7-amine?
4-(1-phenylethoxy)quinazolin-7-amine has a molecular weight of 265.32 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-phenylethoxy)quinazolin-7-amine is sourced from PubChem (CID 65336469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).