N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride

C18H18ClFN4O — CID 2908004

IUPACN-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
SMILESCl.Fc1ccc(Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
InChIInChI=1S/C18H17FN4O.ClH/c19-13-5-7-14(8-6-13)20-18-21-16-4-2-1-3-15(16)17(22-18)23-9-11-24-12-10-23;/h1-8H,9-12H2,(H,20,21,22);1H
InChIKeySYMKACZEQIAOHX-UHFFFAOYSA-N
MW360.82 g/mol
LogP3.77
Rot. Bonds3

About N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride

N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride (PubChem CID 2908004) has the molecular formula C18H18ClFN4O and a molecular weight of 360.82 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
PubChem CID2908004
Molecular FormulaC18H18ClFN4O
Molecular Weight360.82 g/mol
Exact Mass360.12
IUPAC NameN-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
SMILESCl.Fc1ccc(Nc2nc(N3CCOCC3)c3ccccc3n2)cc1
InChIInChI=1S/C18H17FN4O.ClH/c19-13-5-7-14(8-6-13)20-18-21-16-4-2-1-3-15(16)17(22-18)23-9-11-24-12-10-23;/h1-8H,9-12H2,(H,20,21,22);1H
InChIKeySYMKACZEQIAOHX-UHFFFAOYSA-N
XLogP3.77
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.82
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride 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 N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
The IUPAC name of N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride (CID 2908004) is N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride.
What is the SMILES notation for N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
The canonical SMILES for N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride is Cl.Fc1ccc(Nc2nc(N3CCOCC3)c3ccccc3n2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
The InChIKey is SYMKACZEQIAOHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O.ClH/c19-13-5-7-14(8-6-13)20-18-21-16-4-2-1-3-15(16)17(22-18)23-9-11-24-12-10-23;/h1-8H,9-12H2,(H,20,21,22);1H.
What are the key properties of N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride?
N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride has a molecular weight of 360.82 g/mol, XLogP of 3.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride is sourced from PubChem (CID 2908004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).