N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine

C18H17FN4O — CID 39861394

IUPACN-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
SMILESFc1cccc(Nc2nc(N3CCOCC3)c3ccccc3n2)c1
InChIInChI=1S/C18H17FN4O/c19-13-4-3-5-14(12-13)20-18-21-16-7-2-1-6-15(16)17(22-18)23-8-10-24-11-9-23/h1-7,12H,8-11H2,(H,20,21,22)
InChIKeyAREZXKKNUNGSHR-UHFFFAOYSA-N
MW324.36 g/mol
LogP3.35
Rot. Bonds3

About N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine

N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine (PubChem CID 39861394) has the molecular formula C18H17FN4O and a molecular weight of 324.36 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
PubChem CID39861394
Molecular FormulaC18H17FN4O
Molecular Weight324.36 g/mol
Exact Mass324.14
IUPAC NameN-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine
SMILESFc1cccc(Nc2nc(N3CCOCC3)c3ccccc3n2)c1
InChIInChI=1S/C18H17FN4O/c19-13-4-3-5-14(12-13)20-18-21-16-7-2-1-6-15(16)17(22-18)23-8-10-24-11-9-23/h1-7,12H,8-11H2,(H,20,21,22)
InChIKeyAREZXKKNUNGSHR-UHFFFAOYSA-N
XLogP3.35
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-[(4-morpholin-4-ylquinazolin-2-yl)amino]phenyl]ethanol
CID 50946885
N-(4-methylphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
CID 2910267
4-N,4-N-dimethyl-1-N-(4-morpholin-4-ylquinazolin-2-yl)benzene-1,4-diamine;hydrochloride
CID 2972487
2-N,8-N-bis(3-fluorophenyl)-6-morpholin-4-yl-7H-purine-2,8-diamine
CID 10410037
4-fluoro-1-N-(4-pyrrolidin-1-ylquinazolin-2-yl)benzene-1,3-diamine
CID 141431025
2-N-(3-fluorophenyl)-4-N-(3-methoxyphenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 18580341
N-(2,5-dimethoxyphenyl)-4-morpholin-4-ylquinazolin-2-amine;hydrochloride
CID 2975510
4-(2-methylsulfanylquinazolin-4-yl)morpholine
CID 658307
4-[[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]amino]phenol
CID 769532
2-N-(3-methylphenyl)-6-morpholin-4-yl-4-N-phenyl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 18580405
ethane;N-(4-methoxyphenyl)-4-pyrrolidin-1-ylquinazolin-2-amine
CID 143177747
N-(4-methoxyphenyl)-4-piperidin-1-ylquinazolin-2-amine
CID 2095932

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
The IUPAC name of N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine (CID 39861394) is N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine.
What is the SMILES notation for N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
The canonical SMILES for N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine is Fc1cccc(Nc2nc(N3CCOCC3)c3ccccc3n2)c1.
What is the InChIKey of N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
The InChIKey is AREZXKKNUNGSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN4O/c19-13-4-3-5-14(12-13)20-18-21-16-7-2-1-6-15(16)17(22-18)23-8-10-24-11-9-23/h1-7,12H,8-11H2,(H,20,21,22).
What are the key properties of N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine?
N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine has a molecular weight of 324.36 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-morpholin-4-ylquinazolin-2-amine is sourced from PubChem (CID 39861394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).