N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine

C101H77ClF7N25O4 — CID 159335266

About N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine

N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine (PubChem CID 159335266) has the molecular formula C101H77ClF7N25O4 and a molecular weight of 1873.34 g/mol. Its IUPAC name is N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine.

Molecular Properties

• Compound Name: N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine
• PubChem CID: 159335266
• Molecular Formula: C101H77ClF7N25O4
• Molecular Weight: 1873.34 g/mol
• Exact Mass: 1871.62
• IUPAC Name: N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine
• SMILES: CC(=O)Nc1ccc(-c2ccc3ncnc(N)c3c2)cc1.COc1ccc(-c2ccc3ncnc(N)c3c2)cc1OC.Nc1ncnc2ccc(-c3ccc(Cl)cc3)cc12.Nc1ncnc2ccc(-c3ccc(F)cc3)cc12.Nc1ncnc2ccc(-c3cccc(C(F)(F)F)c3)nc12.Nc1ncnc2ccc(-c3cccc(OC(F)(F)F)c3)nc12.Nc1ncnc2ccc(-c3ccccc3)nc12
• InChI: InChI=1S/C16H14N4O.C16H15N3O2.C14H10ClN3.C14H9F3N4O.C14H9F3N4.C14H10FN3.C13H10N4/c1-10(21)20-13-5-2-11(3-6-13)12-4-7-15-14(8-12)16(17)19-9-18-15;1-20-14-6-4-11(8-15(14)21-2)10-3-5-13-12(7-10)16(17)19-9-18-13;15-11-4-1-9(2-5-11)10-3-6-13-12(7-10)14(16)18-8-17-13;15-14(16,17)22-9-3-1-2-8(6-9)10-4-5-11-12(21-10)13(18)20-7-19-11;15-14(16,17)9-3-1-2-8(6-9)10-4-5-11-12(21-10)13(18)20-7-19-11;15-11-4-1-9(2-5-11)10-3-6-13-12(7-10)14(16)18-8-17-13;14-13-12-11(15-8-16-13)7-6-10(17-12)9-4-2-1-3-5-9/h2-9H,1H3,(H,20,21)(H2,17,18,19);3-9H,1-2H3,(H2,17,18,19);1-8H,(H2,16,17,18);1-7H,(H2,18,19,20);1-7H,(H2,18,19,20);1-8H,(H2,16,17,18);1-8H,(H2,14,15,16)
• InChIKey: LFLKAAMITNXQHV-UHFFFAOYSA-N
• XLogP: 21.02
• TPSA: 458.06 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 28
• Rotatable Bonds: 11
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1873.34
LogP ≤ 5	21.02
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine?

The IUPAC name of N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine (CID 159335266) is N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine.

What is the SMILES notation for N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine?

The canonical SMILES for N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine is CC(=O)Nc1ccc(-c2ccc3ncnc(N)c3c2)cc1.COc1ccc(-c2ccc3ncnc(N)c3c2)cc1OC.Nc1ncnc2ccc(-c3ccc(Cl)cc3)cc12.Nc1ncnc2ccc(-c3ccc(F)cc3)cc12.Nc1ncnc2ccc(-c3cccc(C(F)(F)F)c3)nc12.Nc1ncnc2ccc(-c3cccc(OC(F)(F)F)c3)nc12.Nc1ncnc2ccc(-c3ccccc3)nc12.

What is the InChIKey of N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine?

The InChIKey is LFLKAAMITNXQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O.C16H15N3O2.C14H10ClN3.C14H9F3N4O.C14H9F3N4.C14H10FN3.C13H10N4/c1-10(21)20-13-5-2-11(3-6-13)12-4-7-15-14(8-12)16(17)19-9-18-15;1-20-14-6-4-11(8-15(14)21-2)10-3-5-13-12(7-10)16(17)19-9-18-13;15-11-4-1-9(2-5-11)10-3-6-13-12(7-10)14(16)18-8-17-13;15-14(16,17)22-9-3-1-2-8(6-9)10-4-5-11-12(21-10)13(18)20-7-19-11;15-14(16,17)9-3-1-2-8(6-9)10-4-5-11-12(21-10)13(18)20-7-19-11;15-11-4-1-9(2-5-11)10-3-6-13-12(7-10)14(16)18-8-17-13;14-13-12-11(15-8-16-13)7-6-10(17-12)9-4-2-1-3-5-9/h2-9H,1H3,(H,20,21)(H2,17,18,19);3-9H,1-2H3,(H2,17,18,19);1-8H,(H2,16,17,18);1-7H,(H2,18,19,20);1-7H,(H2,18,19,20);1-8H,(H2,16,17,18);1-8H,(H2,14,15,16).

What are the key properties of N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine?

N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine has a molecular weight of 1873.34 g/mol, XLogP of 21.02, 11 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(4-aminoquinazolin-6-yl)phenyl]acetamide;6-(4-chlorophenyl)quinazolin-4-amine;6-(3,4-dimethoxyphenyl)quinazolin-4-amine;6-(4-fluorophenyl)quinazolin-4-amine;6-phenylpyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethoxy)phenyl]pyrido[3,2-d]pyrimidin-4-amine;6-[3-(trifluoromethyl)phenyl]pyrido[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 159335266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).