6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine

C18H17FN4O — CID 24810065

IUPAC6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
SMILESNc1nc(N2CCOCC2)c2cc(-c3ccc(F)cc3)ccc2n1
InChIInChI=1S/C18H17FN4O/c19-14-4-1-12(2-5-14)13-3-6-16-15(11-13)17(22-18(20)21-16)23-7-9-24-10-8-23/h1-6,11H,7-10H2,(H2,20,21,22)
InChIKeyOGXNOKPTLREGQS-UHFFFAOYSA-N
MW324.36 g/mol
LogP2.85
Rot. Bonds2

About 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine

6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine (PubChem CID 24810065) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
PubChem CID24810065
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC Name6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
SMILESNc1nc(N2CCOCC2)c2cc(-c3ccc(F)cc3)ccc2n1
InChIInChI=1S/C18H17FN4O/c19-14-4-1-12(2-5-14)13-3-6-16-15(11-13)17(22-18(20)21-16)23-7-9-24-10-8-23/h1-6,11H,7-10H2,(H2,20,21,22)
InChIKeyOGXNOKPTLREGQS-UHFFFAOYSA-N
XLogP2.85
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
The IUPAC name of 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine (CID 24810065) is 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine.
What is the SMILES notation for 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
The canonical SMILES for 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine is Nc1nc(N2CCOCC2)c2cc(-c3ccc(F)cc3)ccc2n1.
What is the InChIKey of 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
The InChIKey is OGXNOKPTLREGQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O/c19-14-4-1-12(2-5-14)13-3-6-16-15(11-13)17(22-18(20)21-16)23-7-9-24-10-8-23/h1-6,11H,7-10H2,(H2,20,21,22).
What are the key properties of 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine has a molecular weight of 324.36 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine is sourced from PubChem (CID 24810065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).