2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine

C16H14FN3 — CID 64983880

IUPAC2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine
SMILESCc1ccc(C)c(-c2nc(N)c3ccc(F)cc3n2)c1
InChIInChI=1S/C16H14FN3/c1-9-3-4-10(2)13(7-9)16-19-14-8-11(17)5-6-12(14)15(18)20-16/h3-8H,1-2H3,(H2,18,19,20)
InChIKeyQTEDBCLVDXHUFS-UHFFFAOYSA-N
MW267.31 g/mol
LogP3.63
Rot. Bonds1

About 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine

2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine (PubChem CID 64983880) has the molecular formula C16H14FN3 and a molecular weight of 267.31 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine
PubChem CID64983880
Molecular FormulaC16H14FN3
Molecular Weight267.31 g/mol
Exact Mass267.12
IUPAC Name2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine
SMILESCc1ccc(C)c(-c2nc(N)c3ccc(F)cc3n2)c1
InChIInChI=1S/C16H14FN3/c1-9-3-4-10(2)13(7-9)16-19-14-8-11(17)5-6-12(14)15(18)20-16/h3-8H,1-2H3,(H2,18,19,20)
InChIKeyQTEDBCLVDXHUFS-UHFFFAOYSA-N
XLogP3.63
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-fluoro-2-(5-fluoro-2-methylphenyl)quinazolin-4-amine
CID 64983595
2-(2,5-dimethylphenyl)-6-methylquinazolin-4-amine
CID 64983731
7-fluoro-2-(3-methylphenyl)quinazolin-4-amine
CID 64983694
6-bromo-2-(5-fluoro-2-methylphenyl)quinazolin-4-amine
CID 64983352
7-fluoro-2-(2,3,4-trifluorophenyl)quinazolin-4-amine
CID 79755415
2-(2-chlorophenyl)-7-fluoroquinazolin-4-amine
CID 64983741
2-(5-fluoro-2-methylphenyl)-5,6-dimethylpyrimidin-4-amine
CID 55067572
7-fluoro-2-(3,4,5-trifluorophenyl)quinazolin-4-amine
CID 64983363
2-(2,4-dimethylphenyl)-7-fluoro-N-methylquinazolin-4-amine
CID 64981496
6-chloro-2-(2-fluoro-5-methylphenyl)quinazolin-4-amine
CID 64983529
7-fluoro-2-(2-fluoro-6-methoxyphenyl)quinazolin-4-amine
CID 65434083
2-(2,6-difluoro-3-methylphenyl)-6-fluoroquinazolin-4-amine
CID 82800514

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine?
The IUPAC name of 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine (CID 64983880) is 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine?
The canonical SMILES for 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine is Cc1ccc(C)c(-c2nc(N)c3ccc(F)cc3n2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine?
The InChIKey is QTEDBCLVDXHUFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3/c1-9-3-4-10(2)13(7-9)16-19-14-8-11(17)5-6-12(14)15(18)20-16/h3-8H,1-2H3,(H2,18,19,20).
What are the key properties of 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine?
2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine has a molecular weight of 267.31 g/mol, XLogP of 3.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-7-fluoroquinazolin-4-amine is sourced from PubChem (CID 64983880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).