5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone

C92H72Cl6F9N25O6S6 — CID 160592498

IUPAC5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone
SMILESCC(=O)c1cc2c(-c3ccccc3C(F)(F)F)nc(N)nc2s1.CNC(=O)c1cc2c(-c3ccccc3C(F)(F)F)nc(N)nc2s1.CNC(=O)c1sc2nc(N)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNC(=O)c1sc2nc(NC)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNC(=O)c1sc2nc(NC3CC3)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNc1nc(-c2ccccc2C(F)(F)F)c2cc(C(C)=O)sc2n1
InChIInChI=1S/C17H15Cl2N5OS.C16H12F3N3OS.C15H13Cl2N5OS.C15H11F3N4OS.C15H10F3N3OS.C14H11Cl2N5OS/c1-21-15(25)14-12(20)11-13(9-5-2-7(18)6-10(9)19)23-17(22-8-3-4-8)24-16(11)26-14;1-8(23)12-7-10-13(21-15(20-2)22-14(10)24-12)9-5-3-4-6-11(9)16(17,18)19;1-19-13(23)12-10(18)9-11(7-4-3-6(16)5-8(7)17)21-15(20-2)22-14(9)24-12;1-20-12(23)10-6-8-11(21-14(19)22-13(8)24-10)7-4-2-3-5-9(7)15(16,17)18;1-7(22)11-6-9-12(20-14(19)21-13(9)23-11)8-4-2-3-5-10(8)15(16,17)18;1-19-12(22)11-9(17)8-10(20-14(18)21-13(8)23-11)6-3-2-5(15)4-7(6)16/h2,5-6,8H,3-4,20H2,1H3,(H,21,25)(H,22,23,24);3-7H,1-2H3,(H,20,21,22);3-5H,18H2,1-2H3,(H,19,23)(H,20,21,22);2-6H,1H3,(H,20,23)(H2,19,21,22);2-6H,1H3,(H2,19,20,21);2-4H,17H2,1H3,(H,19,22)(H2,18,20,21)
InChIKeyRDFFEWXROBGLAP-UHFFFAOYSA-N
MW2199.86 g/mol
LogP23.12
Rot. Bonds16

About 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone

5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone (PubChem CID 160592498) has the molecular formula C92H72Cl6F9N25O6S6 and a molecular weight of 2199.86 g/mol. Its IUPAC name is 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone.

Molecular Properties

Compound Name5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone
PubChem CID160592498
Molecular FormulaC92H72Cl6F9N25O6S6
Molecular Weight2199.86 g/mol
Exact Mass2195.24
IUPAC Name5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone
SMILESCC(=O)c1cc2c(-c3ccccc3C(F)(F)F)nc(N)nc2s1.CNC(=O)c1cc2c(-c3ccccc3C(F)(F)F)nc(N)nc2s1.CNC(=O)c1sc2nc(N)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNC(=O)c1sc2nc(NC)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNC(=O)c1sc2nc(NC3CC3)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNc1nc(-c2ccccc2C(F)(F)F)c2cc(C(C)=O)sc2n1
InChIInChI=1S/C17H15Cl2N5OS.C16H12F3N3OS.C15H13Cl2N5OS.C15H11F3N4OS.C15H10F3N3OS.C14H11Cl2N5OS/c1-21-15(25)14-12(20)11-13(9-5-2-7(18)6-10(9)19)23-17(22-8-3-4-8)24-16(11)26-14;1-8(23)12-7-10-13(21-15(20-2)22-14(10)24-12)9-5-3-4-6-11(9)16(17,18)19;1-19-13(23)12-10(18)9-11(7-4-3-6(16)5-8(7)17)21-15(20-2)22-14(9)24-12;1-20-12(23)10-6-8-11(21-14(19)22-13(8)24-10)7-4-2-3-5-9(7)15(16,17)18;1-7(22)11-6-9-12(20-14(19)21-13(9)23-11)8-4-2-3-5-10(8)15(16,17)18;1-19-12(22)11-9(17)8-10(20-14(18)21-13(8)23-11)6-3-2-5(15)4-7(6)16/h2,5-6,8H,3-4,20H2,1H3,(H,21,25)(H,22,23,24);3-7H,1-2H3,(H,20,21,22);3-5H,18H2,1-2H3,(H,19,23)(H,20,21,22);2-6H,1H3,(H,20,23)(H2,19,21,22);2-6H,1H3,(H2,19,20,21);2-4H,17H2,1H3,(H,19,22)(H2,18,20,21)
InChIKeyRDFFEWXROBGLAP-UHFFFAOYSA-N
XLogP23.12
TPSA497.43 Ų
H-Bond Donors13
H-Bond Acceptors33
Rotatable Bonds16
Heavy Atoms144
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002199.86
LogP ≤ 523.12
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1033

Analyze 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone?
The IUPAC name of 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone (CID 160592498) is 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone.
What is the SMILES notation for 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone?
The canonical SMILES for 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone is CC(=O)c1cc2c(-c3ccccc3C(F)(F)F)nc(N)nc2s1.CNC(=O)c1cc2c(-c3ccccc3C(F)(F)F)nc(N)nc2s1.CNC(=O)c1sc2nc(N)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNC(=O)c1sc2nc(NC)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNC(=O)c1sc2nc(NC3CC3)nc(-c3ccc(Cl)cc3Cl)c2c1N.CNc1nc(-c2ccccc2C(F)(F)F)c2cc(C(C)=O)sc2n1.
What is the InChIKey of 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone?
The InChIKey is RDFFEWXROBGLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N5OS.C16H12F3N3OS.C15H13Cl2N5OS.C15H11F3N4OS.C15H10F3N3OS.C14H11Cl2N5OS/c1-21-15(25)14-12(20)11-13(9-5-2-7(18)6-10(9)19)23-17(22-8-3-4-8)24-16(11)26-14;1-8(23)12-7-10-13(21-15(20-2)22-14(10)24-12)9-5-3-4-6-11(9)16(17,18)19;1-19-13(23)12-10(18)9-11(7-4-3-6(16)5-8(7)17)21-15(20-2)22-14(9)24-12;1-20-12(23)10-6-8-11(21-14(19)22-13(8)24-10)7-4-2-3-5-9(7)15(16,17)18;1-7(22)11-6-9-12(20-14(19)21-13(9)23-11)8-4-2-3-5-10(8)15(16,17)18;1-19-12(22)11-9(17)8-10(20-14(18)21-13(8)23-11)6-3-2-5(15)4-7(6)16/h2,5-6,8H,3-4,20H2,1H3,(H,21,25)(H,22,23,24);3-7H,1-2H3,(H,20,21,22);3-5H,18H2,1-2H3,(H,19,23)(H,20,21,22);2-6H,1H3,(H,20,23)(H2,19,21,22);2-6H,1H3,(H2,19,20,21);2-4H,17H2,1H3,(H,19,22)(H2,18,20,21).
What are the key properties of 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone?
5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone has a molecular weight of 2199.86 g/mol, XLogP of 23.12, 16 rotatable bonds, 13 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(cyclopropylamino)-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;5-amino-4-(2,4-dichlorophenyl)-N-methyl-2-(methylamino)thieno[2,3-d]pyrimidine-6-carboxamide;2-amino-N-methyl-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide;1-[2-amino-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone;2,5-diamino-4-(2,4-dichlorophenyl)-N-methylthieno[2,3-d]pyrimidine-6-carboxamide;1-[2-(methylamino)-4-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidin-6-yl]ethanone is sourced from PubChem (CID 160592498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).