3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide

C102H103F4N23O11S6 — CID 158059642

About 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide

3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide (PubChem CID 158059642) has the molecular formula C102H103F4N23O11S6 and a molecular weight of 2095.49 g/mol. Its IUPAC name is 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide.

Molecular Properties

• Compound Name: 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide
• PubChem CID: 158059642
• Molecular Formula: C102H103F4N23O11S6
• Molecular Weight: 2095.49 g/mol
• Exact Mass: 2093.65
• IUPAC Name: 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide
• SMILES: CCC(C)Oc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.CCOc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.CCOc1cc(F)ccc1Nc1ncnc2cc(C)sc12.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC(C)C)c2s1.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC3CCCC3)c2s1.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OCCC(F)(F)F)c2s1
• InChI: InChI=1S/C19H20N4O2S.C18H20N4O2S.C17H15F3N4O2S.C17H18N4O2S.C16H16N4O2S.C15H14FN3OS/c1-11-8-15-17(26-11)19(22-10-21-15)23-14-7-6-12(18(20)24)9-16(14)25-13-4-2-3-5-13;1-4-10(2)24-15-8-12(17(19)23)5-6-13(15)22-18-16-14(20-9-21-18)7-11(3)25-16;1-9-6-12-14(27-9)16(23-8-22-12)24-11-3-2-10(15(21)25)7-13(11)26-5-4-17(18,19)20;1-9(2)23-14-7-11(16(18)22)4-5-12(14)21-17-15-13(19-8-20-17)6-10(3)24-15;1-3-22-13-7-10(15(17)21)4-5-11(13)20-16-14-12(18-8-19-16)6-9(2)23-14;1-3-20-13-7-10(16)4-5-11(13)19-15-14-12(17-8-18-15)6-9(2)21-14/h6-10,13H,2-5H2,1H3,(H2,20,24)(H,21,22,23);5-10H,4H2,1-3H3,(H2,19,23)(H,20,21,22);2-3,6-8H,4-5H2,1H3,(H2,21,25)(H,22,23,24);4-9H,1-3H3,(H2,18,22)(H,19,20,21);4-8H,3H2,1-2H3,(H2,17,21)(H,18,19,20);4-8H,3H2,1-2H3,(H,17,18,19)
• InChIKey: FKMFZCKXGHXHCJ-UHFFFAOYSA-N
• XLogP: 23.51
• TPSA: 497.69 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 35
• Rotatable Bonds: 31
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2095.49
LogP ≤ 5	23.51
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide?

The IUPAC name of 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide (CID 158059642) is 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide.

What is the SMILES notation for 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide?

The canonical SMILES for 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide is CCC(C)Oc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.CCOc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.CCOc1cc(F)ccc1Nc1ncnc2cc(C)sc12.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC(C)C)c2s1.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC3CCCC3)c2s1.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OCCC(F)(F)F)c2s1.

What is the InChIKey of 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide?

The InChIKey is FKMFZCKXGHXHCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2S.C18H20N4O2S.C17H15F3N4O2S.C17H18N4O2S.C16H16N4O2S.C15H14FN3OS/c1-11-8-15-17(26-11)19(22-10-21-15)23-14-7-6-12(18(20)24)9-16(14)25-13-4-2-3-5-13;1-4-10(2)24-15-8-12(17(19)23)5-6-13(15)22-18-16-14(20-9-21-18)7-11(3)25-16;1-9-6-12-14(27-9)16(23-8-22-12)24-11-3-2-10(15(21)25)7-13(11)26-5-4-17(18,19)20;1-9(2)23-14-7-11(16(18)22)4-5-12(14)21-17-15-13(19-8-20-17)6-10(3)24-15;1-3-22-13-7-10(15(17)21)4-5-11(13)20-16-14-12(18-8-19-16)6-9(2)23-14;1-3-20-13-7-10(16)4-5-11(13)19-15-14-12(17-8-18-15)6-9(2)21-14/h6-10,13H,2-5H2,1H3,(H2,20,24)(H,21,22,23);5-10H,4H2,1-3H3,(H2,19,23)(H,20,21,22);2-3,6-8H,4-5H2,1H3,(H2,21,25)(H,22,23,24);4-9H,1-3H3,(H2,18,22)(H,19,20,21);4-8H,3H2,1-2H3,(H2,17,21)(H,18,19,20);4-8H,3H2,1-2H3,(H,17,18,19).

What are the key properties of 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide?

3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide has a molecular weight of 2095.49 g/mol, XLogP of 23.51, 31 rotatable bonds, 11 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 3-butan-2-yloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;3-cyclopentyloxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(2-ethoxy-4-fluorophenyl)-6-methylthieno[3,2-d]pyrimidin-4-amine;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-(3,3,3-trifluoropropoxy)benzamide is sourced from PubChem (CID 158059642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).