[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone

C85H80N22O11S7 — CID 158713608

About [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone

[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone (PubChem CID 158713608) has the molecular formula C85H80N22O11S7 and a molecular weight of 1810.19 g/mol. Its IUPAC name is [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone.

Molecular Properties

• Compound Name: [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone
• PubChem CID: 158713608
• Molecular Formula: C85H80N22O11S7
• Molecular Weight: 1810.19 g/mol
• Exact Mass: 1808.44
• IUPAC Name: [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone
• SMILES: C#Cc1cccc(-c2nc(N)c3cc(C(=O)N4CCOCC4)sc3n2)c1.C#Cc1cccc(-c2nc(N)c3cc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)sc3n2)c1.Cc1ccc(-c2nc(N)c3cc(C(=O)N4CCOCC4)sc3n2)o1.Cc1csc(-c2nc(N)c3cc(C(=O)N4CCOCC4)sc3n2)n1.Nc1nc(-c2nccs2)nc2sc(C(=O)N3CCOCC3)cc12
• InChI: InChI=1S/C21H20N4O2S.C19H16N4O2S.C16H16N4O3S.C15H15N5O2S2.C14H13N5O2S2/c1-4-14-6-5-7-15(8-14)19-23-18(22)16-9-17(28-20(16)24-19)21(26)25-10-12(2)27-13(3)11-25;1-2-12-4-3-5-13(10-12)17-21-16(20)14-11-15(26-18(14)22-17)19(24)23-6-8-25-9-7-23;1-9-2-3-11(23-9)14-18-13(17)10-8-12(24-15(10)19-14)16(21)20-4-6-22-7-5-20;1-8-7-23-14(17-8)12-18-11(16)9-6-10(24-13(9)19-12)15(21)20-2-4-22-5-3-20;15-10-8-7-9(14(20)19-2-4-21-5-3-19)23-12(8)18-11(17-10)13-16-1-6-22-13/h1,5-9,12-13H,10-11H2,2-3H3,(H2,22,23,24);1,3-5,10-11H,6-9H2,(H2,20,21,22);2-3,8H,4-7H2,1H3,(H2,17,18,19);6-7H,2-5H2,1H3,(H2,16,18,19);1,6-7H,2-5H2,(H2,15,17,18)/t12-,13+
• InChIKey: IJANJOASNAJEPQ-BTEZEUSHSA-N
• XLogP: 11.93
• TPSA: 445.62 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 35
• Rotatable Bonds: 10
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1810.19
LogP ≤ 5	11.93
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone?

The IUPAC name of [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone (CID 158713608) is [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone.

What is the SMILES notation for [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone?

The canonical SMILES for [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone is C#Cc1cccc(-c2nc(N)c3cc(C(=O)N4CCOCC4)sc3n2)c1.C#Cc1cccc(-c2nc(N)c3cc(C(=O)N4C[C@@H](C)O[C@@H](C)C4)sc3n2)c1.Cc1ccc(-c2nc(N)c3cc(C(=O)N4CCOCC4)sc3n2)o1.Cc1csc(-c2nc(N)c3cc(C(=O)N4CCOCC4)sc3n2)n1.Nc1nc(-c2nccs2)nc2sc(C(=O)N3CCOCC3)cc12.

What is the InChIKey of [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone?

The InChIKey is IJANJOASNAJEPQ-BTEZEUSHSA-N. The full InChI is InChI=1S/C21H20N4O2S.C19H16N4O2S.C16H16N4O3S.C15H15N5O2S2.C14H13N5O2S2/c1-4-14-6-5-7-15(8-14)19-23-18(22)16-9-17(28-20(16)24-19)21(26)25-10-12(2)27-13(3)11-25;1-2-12-4-3-5-13(10-12)17-21-16(20)14-11-15(26-18(14)22-17)19(24)23-6-8-25-9-7-23;1-9-2-3-11(23-9)14-18-13(17)10-8-12(24-15(10)19-14)16(21)20-4-6-22-7-5-20;1-8-7-23-14(17-8)12-18-11(16)9-6-10(24-13(9)19-12)15(21)20-2-4-22-5-3-20;15-10-8-7-9(14(20)19-2-4-21-5-3-19)23-12(8)18-11(17-10)13-16-1-6-22-13/h1,5-9,12-13H,10-11H2,2-3H3,(H2,22,23,24);1,3-5,10-11H,6-9H2,(H2,20,21,22);2-3,8H,4-7H2,1H3,(H2,17,18,19);6-7H,2-5H2,1H3,(H2,16,18,19);1,6-7H,2-5H2,(H2,15,17,18)/t12-,13+;;;;.

What are the key properties of [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone?

[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone has a molecular weight of 1810.19 g/mol, XLogP of 11.93, 10 rotatable bonds, 5 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for [4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-[(2R,6S)-2,6-dimethylmorpholin-4-yl]methanone;[4-amino-2-(3-ethynylphenyl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;[4-amino-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 158713608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).