2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate

C118H113N19O26S6 — CID 158468067

About 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate

2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate (PubChem CID 158468067) has the molecular formula C118H113N19O26S6 and a molecular weight of 2405.71 g/mol. Its IUPAC name is 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate.

Molecular Properties

• Compound Name: 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate
• PubChem CID: 158468067
• Molecular Formula: C118H113N19O26S6
• Molecular Weight: 2405.71 g/mol
• Exact Mass: 2403.64
• IUPAC Name: 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate
• SMILES: C=Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(C(=O)C3CCOCC3)s2)cn1.Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(C(=O)C3CCOCC3)s2)cn1.Cc1ncc(C(=O)Nc2nc(-c3ccco3)c(C(=O)C3CCOCC3)s2)cn1.O=C(CN1CC=CCC1)Nc1nc(-c2ccco2)c(C(=O)C2CCOCC2)s1.O=C(Nc1nc(-c2ccco2)c(C(=O)C2CCOCC2)s1)Oc1cccnc1.O=C(Nc1nc(-c2ccco2)c(C(=O)c2ccccn2)s1)OC1CCOCC1
• InChI: InChI=1S/C21H19N3O4S.C20H19N3O4S.C20H23N3O4S.C19H18N4O4S.2C19H17N3O5S/c1-2-15-6-5-14(12-22-15)20(26)24-21-23-17(16-4-3-9-28-16)19(29-21)18(25)13-7-10-27-11-8-13;1-12-4-5-14(11-21-12)19(25)23-20-22-16(15-3-2-8-27-15)18(28-20)17(24)13-6-9-26-10-7-13;24-16(13-23-8-2-1-3-9-23)21-20-22-17(15-5-4-10-27-15)19(28-20)18(25)14-6-11-26-12-7-14;1-11-20-9-13(10-21-11)18(25)23-19-22-15(14-3-2-6-27-14)17(28-19)16(24)12-4-7-26-8-5-12;23-16(12-5-9-25-10-6-12)17-15(14-4-2-8-26-14)21-18(28-17)22-19(24)27-13-3-1-7-20-11-13;23-16(13-4-1-2-8-20-13)17-15(14-5-3-9-26-14)21-18(28-17)22-19(24)27-12-6-10-25-11-7-12/h2-6,9,12-13H,1,7-8,10-11H2,(H,23,24,26);2-5,8,11,13H,6-7,9-10H2,1H3,(H,22,23,25);1-2,4-5,10,14H,3,6-9,11-13H2,(H,21,22,24);2-3,6,9-10,12H,4-5,7-8H2,1H3,(H,22,23,25);1-4,7-8,11-12H,5-6,9-10H2,(H,21,22,24);1-5,8-9,12H,6-7,10-11H2,(H,21,22,24)
• InChIKey: HFZUPMJEFDFRMB-UHFFFAOYSA-N
• XLogP: 22.62
• TPSA: 587.62 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 45
• Rotatable Bonds: 32
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2405.71
LogP ≤ 5	22.62
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate?

The IUPAC name of 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate (CID 158468067) is 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate.

What is the SMILES notation for 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate?

The canonical SMILES for 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate is C=Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(C(=O)C3CCOCC3)s2)cn1.Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(C(=O)C3CCOCC3)s2)cn1.Cc1ncc(C(=O)Nc2nc(-c3ccco3)c(C(=O)C3CCOCC3)s2)cn1.O=C(CN1CC=CCC1)Nc1nc(-c2ccco2)c(C(=O)C2CCOCC2)s1.O=C(Nc1nc(-c2ccco2)c(C(=O)C2CCOCC2)s1)Oc1cccnc1.O=C(Nc1nc(-c2ccco2)c(C(=O)c2ccccn2)s1)OC1CCOCC1.

What is the InChIKey of 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate?

The InChIKey is HFZUPMJEFDFRMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O4S.C20H19N3O4S.C20H23N3O4S.C19H18N4O4S.2C19H17N3O5S/c1-2-15-6-5-14(12-22-15)20(26)24-21-23-17(16-4-3-9-28-16)19(29-21)18(25)13-7-10-27-11-8-13;1-12-4-5-14(11-21-12)19(25)23-20-22-16(15-3-2-8-27-15)18(28-20)17(24)13-6-9-26-10-7-13;24-16(13-23-8-2-1-3-9-23)21-20-22-17(15-5-4-10-27-15)19(28-20)18(25)14-6-11-26-12-7-14;1-11-20-9-13(10-21-11)18(25)23-19-22-15(14-3-2-6-27-14)17(28-19)16(24)12-4-7-26-8-5-12;23-16(12-5-9-25-10-6-12)17-15(14-4-2-8-26-14)21-18(28-17)22-19(24)27-13-3-1-7-20-11-13;23-16(13-4-1-2-8-20-13)17-15(14-5-3-9-26-14)21-18(28-17)22-19(24)27-12-6-10-25-11-7-12/h2-6,9,12-13H,1,7-8,10-11H2,(H,23,24,26);2-5,8,11,13H,6-7,9-10H2,1H3,(H,22,23,25);1-2,4-5,10,14H,3,6-9,11-13H2,(H,21,22,24);2-3,6,9-10,12H,4-5,7-8H2,1H3,(H,22,23,25);1-4,7-8,11-12H,5-6,9-10H2,(H,21,22,24);1-5,8-9,12H,6-7,10-11H2,(H,21,22,24).

What are the key properties of 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate?

2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate has a molecular weight of 2405.71 g/mol, XLogP of 22.62, 32 rotatable bonds, 6 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3,6-dihydro-2H-pyridin-1-yl)-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]acetamide;6-ethenyl-N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-6-methylpyridine-3-carboxamide;N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]-2-methylpyrimidine-5-carboxamide;oxan-4-yl N-[4-(furan-2-yl)-5-(pyridine-2-carbonyl)-1,3-thiazol-2-yl]carbamate;pyridin-3-yl N-[4-(furan-2-yl)-5-(oxane-4-carbonyl)-1,3-thiazol-2-yl]carbamate is sourced from PubChem (CID 158468067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).