N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide

C90H87N27O10S4 — CID 158598541

IUPACN-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide
SMILESCOc1ncc(CCNC(=O)c2csc3nc(-c4ccccn4)nc(N4CCOCC4)c23)cn1.O=C(NCCc1cc[nH]c(=O)c1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.O=C(NCCc1ccncn1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.O=C(NCCc1cncnc1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12
InChIInChI=1S/C23H23N7O3S.C23H22N6O3S.2C22H21N7O2S/c1-32-23-26-12-15(13-27-23)5-7-25-21(31)16-14-34-22-18(16)20(30-8-10-33-11-9-30)28-19(29-22)17-4-2-3-6-24-17;30-18-13-15(4-7-25-18)5-8-26-22(31)16-14-33-23-19(16)21(29-9-11-32-12-10-29)27-20(28-23)17-3-1-2-6-24-17;30-21(25-8-5-15-4-7-23-14-26-15)16-13-32-22-18(16)20(29-9-11-31-12-10-29)27-19(28-22)17-3-1-2-6-24-17;30-21(26-6-4-15-11-23-14-24-12-15)16-13-32-22-18(16)20(29-7-9-31-10-8-29)27-19(28-22)17-3-1-2-5-25-17/h2-4,6,12-14H,5,7-11H2,1H3,(H,25,31);1-4,6-7,13-14H,5,8-12H2,(H,25,30)(H,26,31);1-4,6-7,13-14H,5,8-12H2,(H,25,30);1-3,5,11-14H,4,6-10H2,(H,26,30)
InChIKeyHVIIOTSYFYNEML-UHFFFAOYSA-N
MW1835.13 g/mol
LogP9.32
Rot. Bonds25

About N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide

N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide (PubChem CID 158598541) has the molecular formula C90H87N27O10S4 and a molecular weight of 1835.13 g/mol. Its IUPAC name is N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide
PubChem CID158598541
Molecular FormulaC90H87N27O10S4
Molecular Weight1835.13 g/mol
Exact Mass1833.60
IUPAC NameN-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide
SMILESCOc1ncc(CCNC(=O)c2csc3nc(-c4ccccn4)nc(N4CCOCC4)c23)cn1.O=C(NCCc1cc[nH]c(=O)c1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.O=C(NCCc1ccncn1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.O=C(NCCc1cncnc1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12
InChIInChI=1S/C23H23N7O3S.C23H22N6O3S.2C22H21N7O2S/c1-32-23-26-12-15(13-27-23)5-7-25-21(31)16-14-34-22-18(16)20(30-8-10-33-11-9-30)28-19(29-22)17-4-2-3-6-24-17;30-18-13-15(4-7-25-18)5-8-26-22(31)16-14-33-23-19(16)21(29-9-11-32-12-10-29)27-20(28-23)17-3-1-2-6-24-17;30-21(25-8-5-15-4-7-23-14-26-15)16-13-32-22-18(16)20(29-9-11-31-12-10-29)27-19(28-22)17-3-1-2-6-24-17;30-21(26-6-4-15-11-23-14-24-12-15)16-13-32-22-18(16)20(29-7-9-31-10-8-29)27-19(28-22)17-3-1-2-5-25-17/h2-4,6,12-14H,5,7-11H2,1H3,(H,25,31);1-4,6-7,13-14H,5,8-12H2,(H,25,30)(H,26,31);1-4,6-7,13-14H,5,8-12H2,(H,25,30);1-3,5,11-14H,4,6-10H2,(H,26,30)
InChIKeyHVIIOTSYFYNEML-UHFFFAOYSA-N
XLogP9.32
TPSA440.39 Ų
H-Bond Donors5
H-Bond Acceptors36
Rotatable Bonds25
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001835.13
LogP ≤ 59.32
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1036

Analyze N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide with MolForge

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Related Compounds

[4-amino-2-[4-(1,1-difluoroethyl)-1,3-thiazol-2-yl]thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone;4-amino-2-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide;4-amino-N-(2-morpholin-4-ylethyl)-2-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide;4-amino-2-(1,3-oxazol-2-yl)-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 160169813
US10940139, Example 02899
CID 137429821
N-(2-methoxyethyl)-2,5-dimethyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 3368423
2,5-dimethyl-N-(pyridin-2-ylmethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 6615502
5-methyl-N-(3-morpholinopropyl)-4-[4-(2-pyridyl)piperazino]thieno[2,3-d]pyrimidine-6-carboxamide
CID 6616993
2,5-dimethyl-N-(2-morpholin-4-ylethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 6617011
5-methyl-N-(2-morpholin-4-ylethyl)-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 6617039
5-methyl-4-morpholin-4-yl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxamide
CID 23827864
[5-Methyl-4-[(6-methyl-2-pyridinyl)methylamino]thieno[2,3-d]pyrimidin-6-yl]-morpholin-4-ylmethanone
CID 126467438
[4-[5,6-Dimethyl-4-(4-morpholin-4-ylanilino)thieno[2,3-d]pyrimidin-2-yl]piperazin-1-yl]-pyridin-4-ylmethanone
CID 16034839
4-[5,6-Dimethyl-4-(4-morpholin-4-yl-phenylamino)-thieno[2,3-d]pyrimidin-2-yl]-piperazin-1-yl-pyridin-2-yl-methanone
CID 16064789
[4-[5,6-Dimethyl-4-(4-morpholin-4-ylanilino)thieno[2,3-d]pyrimidin-2-yl]piperazin-1-yl]-pyridin-3-ylmethanone
CID 16064790

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide?
The IUPAC name of N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide (CID 158598541) is N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide.
What is the SMILES notation for N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide?
The canonical SMILES for N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide is COc1ncc(CCNC(=O)c2csc3nc(-c4ccccn4)nc(N4CCOCC4)c23)cn1.O=C(NCCc1cc[nH]c(=O)c1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.O=C(NCCc1ccncn1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.O=C(NCCc1cncnc1)c1csc2nc(-c3ccccn3)nc(N3CCOCC3)c12.
What is the InChIKey of N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide?
The InChIKey is HVIIOTSYFYNEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O3S.C23H22N6O3S.2C22H21N7O2S/c1-32-23-26-12-15(13-27-23)5-7-25-21(31)16-14-34-22-18(16)20(30-8-10-33-11-9-30)28-19(29-22)17-4-2-3-6-24-17;30-18-13-15(4-7-25-18)5-8-26-22(31)16-14-33-23-19(16)21(29-9-11-32-12-10-29)27-20(28-23)17-3-1-2-6-24-17;30-21(25-8-5-15-4-7-23-14-26-15)16-13-32-22-18(16)20(29-9-11-31-12-10-29)27-19(28-22)17-3-1-2-6-24-17;30-21(26-6-4-15-11-23-14-24-12-15)16-13-32-22-18(16)20(29-7-9-31-10-8-29)27-19(28-22)17-3-1-2-5-25-17/h2-4,6,12-14H,5,7-11H2,1H3,(H,25,31);1-4,6-7,13-14H,5,8-12H2,(H,25,30)(H,26,31);1-4,6-7,13-14H,5,8-12H2,(H,25,30);1-3,5,11-14H,4,6-10H2,(H,26,30).
What are the key properties of N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide?
N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide has a molecular weight of 1835.13 g/mol, XLogP of 9.32, 25 rotatable bonds, 5 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxypyrimidin-5-yl)ethyl]-4-morpholin-4-yl-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-N-[2-(2-oxo-1H-pyridin-4-yl)ethyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-4-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide;4-morpholin-4-yl-2-pyridin-2-yl-N-(2-pyrimidin-5-ylethyl)thieno[2,3-d]pyrimidine-5-carboxamide is sourced from PubChem (CID 158598541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).