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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide

C101H102N26O9S6 — CID 158647364

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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide (PubChem CID 158647364) has the molecular formula C101H102N26O9S6 and a molecular weight of 2016.50 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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide
• PubChem CID: 158647364
• Molecular Formula: C101H102N26O9S6
• Molecular Weight: 2016.50 g/mol
• Exact Mass: 2014.66
• 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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide
• SMILES: CCC(C)Oc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.CCOc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC(C)C)c2s1.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC3CCCC3)c2s1.Cc1csc2c(Nc3ccc4[nH]ncc4c3)ncnc12.NC(=O)c1ccc(Nc2ncnc3ccsc23)c(N2CCCC2)c1
• InChI: InChI=1S/C19H20N4O2S.C18H20N4O2S.C17H17N5OS.C17H18N4O2S.C16H16N4O2S.C14H11N5S/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;18-16(23)11-3-4-12(14(9-11)22-6-1-2-7-22)21-17-15-13(5-8-24-15)19-10-20-17;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;1-8-6-20-13-12(8)15-7-16-14(13)18-10-2-3-11-9(4-10)5-17-19-11/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);3-5,8-10H,1-2,6-7H2,(H2,18,23)(H,19,20,21);4-9H,1-3H3,(H2,18,22)(H,19,20,21);4-8H,3H2,1-2H3,(H2,17,21)(H,18,19,20);2-7H,1H3,(H,17,19)(H,15,16,18)
• InChIKey: IBDBEQNGMVPPCN-UHFFFAOYSA-N
• XLogP: 21.81
• TPSA: 511.15 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 35
• Rotatable Bonds: 27
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2016.50
LogP ≤ 5	21.81
H-Bond Donors ≤ 5	12
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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide (CID 158647364) 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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide is CCC(C)Oc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.CCOc1cc(C(N)=O)ccc1Nc1ncnc2cc(C)sc12.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC(C)C)c2s1.Cc1cc2ncnc(Nc3ccc(C(N)=O)cc3OC3CCCC3)c2s1.Cc1csc2c(Nc3ccc4[nH]ncc4c3)ncnc12.NC(=O)c1ccc(Nc2ncnc3ccsc23)c(N2CCCC2)c1.

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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide?

The InChIKey is IBDBEQNGMVPPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2S.C18H20N4O2S.C17H17N5OS.C17H18N4O2S.C16H16N4O2S.C14H11N5S/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;18-16(23)11-3-4-12(14(9-11)22-6-1-2-7-22)21-17-15-13(5-8-24-15)19-10-20-17;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;1-8-6-20-13-12(8)15-7-16-14(13)18-10-2-3-11-9(4-10)5-17-19-11/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);3-5,8-10H,1-2,6-7H2,(H2,18,23)(H,19,20,21);4-9H,1-3H3,(H2,18,22)(H,19,20,21);4-8H,3H2,1-2H3,(H2,17,21)(H,18,19,20);2-7H,1H3,(H,17,19)(H,15,16,18).

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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide has a molecular weight of 2016.50 g/mol, XLogP of 21.81, 27 rotatable bonds, 12 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;3-ethoxy-4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]benzamide;N-(1H-indazol-5-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine;4-[(6-methylthieno[3,2-d]pyrimidin-4-yl)amino]-3-propan-2-yloxybenzamide;3-pyrrolidin-1-yl-4-(thieno[3,2-d]pyrimidin-4-ylamino)benzamide is sourced from PubChem (CID 158647364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).