8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine

C24H21FN4O — CID 175010411

IUPAC8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine
SMILESFc1ccccc1-c1cccc2cnc(Nc3ccc(C4CNCCO4)cc3)nc12
InChIInChI=1S/C24H21FN4O/c25-21-7-2-1-5-19(21)20-6-3-4-17-14-27-24(29-23(17)20)28-18-10-8-16(9-11-18)22-15-26-12-13-30-22/h1-11,14,22,26H,12-13,15H2,(H,27,28,29)
InChIKeyBNABFMRMSYFCMJ-UHFFFAOYSA-N
MW400.46 g/mol
LogP4.84
Rot. Bonds4

About 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine

8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine (PubChem CID 175010411) has the molecular formula C24H21FN4O and a molecular weight of 400.46 g/mol. Its IUPAC name is 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine.

Molecular Properties

Compound Name8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine
PubChem CID175010411
Molecular FormulaC24H21FN4O
Molecular Weight400.46 g/mol
Exact Mass400.17
IUPAC Name8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine
SMILESFc1ccccc1-c1cccc2cnc(Nc3ccc(C4CNCCO4)cc3)nc12
InChIInChI=1S/C24H21FN4O/c25-21-7-2-1-5-19(21)20-6-3-4-17-14-27-24(29-23(17)20)28-18-10-8-16(9-11-18)22-15-26-12-13-30-22/h1-11,14,22,26H,12-13,15H2,(H,27,28,29)
InChIKeyBNABFMRMSYFCMJ-UHFFFAOYSA-N
XLogP4.84
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.46
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-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 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
The IUPAC name of 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine (CID 175010411) is 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine.
What is the SMILES notation for 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
The canonical SMILES for 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine is Fc1ccccc1-c1cccc2cnc(Nc3ccc(C4CNCCO4)cc3)nc12.
What is the InChIKey of 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
The InChIKey is BNABFMRMSYFCMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN4O/c25-21-7-2-1-5-19(21)20-6-3-4-17-14-27-24(29-23(17)20)28-18-10-8-16(9-11-18)22-15-26-12-13-30-22/h1-11,14,22,26H,12-13,15H2,(H,27,28,29).
What are the key properties of 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine?
8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine has a molecular weight of 400.46 g/mol, XLogP of 4.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-fluorophenyl)-N-(4-morpholin-2-ylphenyl)quinazolin-2-amine is sourced from PubChem (CID 175010411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).