2-ethyl-6-phenoxyquinazolin-4-amine

C16H15N3O — CID 106584239

IUPAC2-ethyl-6-phenoxyquinazolin-4-amine
SMILESCCc1nc(N)c2cc(Oc3ccccc3)ccc2n1
InChIInChI=1S/C16H15N3O/c1-2-15-18-14-9-8-12(10-13(14)16(17)19-15)20-11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H2,17,18,19)
InChIKeyBELRDSXMJJFJSP-UHFFFAOYSA-N
MW265.32 g/mol
LogP3.57
Rot. Bonds3

About 2-ethyl-6-phenoxyquinazolin-4-amine

2-ethyl-6-phenoxyquinazolin-4-amine (PubChem CID 106584239) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2-ethyl-6-phenoxyquinazolin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-phenoxyquinazolin-4-amine
PubChem CID106584239
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2-ethyl-6-phenoxyquinazolin-4-amine
SMILESCCc1nc(N)c2cc(Oc3ccccc3)ccc2n1
InChIInChI=1S/C16H15N3O/c1-2-15-18-14-9-8-12(10-13(14)16(17)19-15)20-11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H2,17,18,19)
InChIKeyBELRDSXMJJFJSP-UHFFFAOYSA-N
XLogP3.57
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 ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-phenoxyquinazolin-4-amine?
The IUPAC name of 2-ethyl-6-phenoxyquinazolin-4-amine (CID 106584239) is 2-ethyl-6-phenoxyquinazolin-4-amine.
What is the SMILES notation for 2-ethyl-6-phenoxyquinazolin-4-amine?
The canonical SMILES for 2-ethyl-6-phenoxyquinazolin-4-amine is CCc1nc(N)c2cc(Oc3ccccc3)ccc2n1.
What is the InChIKey of 2-ethyl-6-phenoxyquinazolin-4-amine?
The InChIKey is BELRDSXMJJFJSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c1-2-15-18-14-9-8-12(10-13(14)16(17)19-15)20-11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H2,17,18,19).
What are the key properties of 2-ethyl-6-phenoxyquinazolin-4-amine?
2-ethyl-6-phenoxyquinazolin-4-amine has a molecular weight of 265.32 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-phenoxyquinazolin-4-amine is sourced from PubChem (CID 106584239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).