N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide

C109H93F3N18O13S3 — CID 161202651

About N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide

N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 161202651) has the molecular formula C109H93F3N18O13S3 and a molecular weight of 2016.25 g/mol. Its IUPAC name is N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

• Compound Name: N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
• PubChem CID: 161202651
• Molecular Formula: C109H93F3N18O13S3
• Molecular Weight: 2016.25 g/mol
• Exact Mass: 2014.63
• IUPAC Name: N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide
• SMILES: CNC(=O)c1csc(NC(=O)[C@@H](c2ccccc2)N2Cc3ccccc3C2=O)n1.O=C(NCCN1CCOCC1)c1csc(NC(=O)[C@@H](c2ccccc2)N2Cc3ccccc3C2=O)n1.O=C(Nc1cccnc1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O.O=C(Nc1ccncc1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O.O=C(Nc1nc(C(F)(F)F)cs1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O
• InChI: InChI=1S/C26H27N5O4S.C21H18N4O3S.2C21H17N3O2.C20H14F3N3O2S/c32-23(27-10-11-30-12-14-35-15-13-30)21-17-36-26(28-21)29-24(33)22(18-6-2-1-3-7-18)31-16-19-8-4-5-9-20(19)25(31)34;1-22-18(26)16-12-29-21(23-16)24-19(27)17(13-7-3-2-4-8-13)25-11-14-9-5-6-10-15(14)20(25)28;25-20(23-17-10-6-12-22-13-17)19(15-7-2-1-3-8-15)24-14-16-9-4-5-11-18(16)21(24)26;25-20(23-17-10-12-22-13-11-17)19(15-6-2-1-3-7-15)24-14-16-8-4-5-9-18(16)21(24)26;21-20(22,23)15-11-29-19(24-15)25-17(27)16(12-6-2-1-3-7-12)26-10-13-8-4-5-9-14(13)18(26)28/h1-9,17,22H,10-16H2,(H,27,32)(H,28,29,33);2-10,12,17H,11H2,1H3,(H,22,26)(H,23,24,27);1-13,19H,14H2,(H,23,25);1-13,19H,14H2,(H,22,23,25);1-9,11,16H,10H2,(H,24,25,27)/t22-;17-;2*19-;16-/m11111/s1
• InChIKey: UVEMHLQCXIWOGJ-RLXJJBKVSA-N
• XLogP: 16.71
• TPSA: 382.17 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 22
• Rotatable Bonds: 25
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2016.25
LogP ≤ 5	16.71
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?

The IUPAC name of N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide (CID 161202651) is N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide.

What is the SMILES notation for N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?

The canonical SMILES for N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide is CNC(=O)c1csc(NC(=O)[C@@H](c2ccccc2)N2Cc3ccccc3C2=O)n1.O=C(NCCN1CCOCC1)c1csc(NC(=O)[C@@H](c2ccccc2)N2Cc3ccccc3C2=O)n1.O=C(Nc1cccnc1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O.O=C(Nc1ccncc1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O.O=C(Nc1nc(C(F)(F)F)cs1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O.

What is the InChIKey of N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?

The InChIKey is UVEMHLQCXIWOGJ-RLXJJBKVSA-N. The full InChI is InChI=1S/C26H27N5O4S.C21H18N4O3S.2C21H17N3O2.C20H14F3N3O2S/c32-23(27-10-11-30-12-14-35-15-13-30)21-17-36-26(28-21)29-24(33)22(18-6-2-1-3-7-18)31-16-19-8-4-5-9-20(19)25(31)34;1-22-18(26)16-12-29-21(23-16)24-19(27)17(13-7-3-2-4-8-13)25-11-14-9-5-6-10-15(14)20(25)28;25-20(23-17-10-6-12-22-13-17)19(15-7-2-1-3-8-15)24-14-16-9-4-5-11-18(16)21(24)26;25-20(23-17-10-12-22-13-11-17)19(15-6-2-1-3-7-15)24-14-16-8-4-5-9-18(16)21(24)26;21-20(22,23)15-11-29-19(24-15)25-17(27)16(12-6-2-1-3-7-12)26-10-13-8-4-5-9-14(13)18(26)28/h1-9,17,22H,10-16H2,(H,27,32)(H,28,29,33);2-10,12,17H,11H2,1H3,(H,22,26)(H,23,24,27);1-13,19H,14H2,(H,23,25);1-13,19H,14H2,(H,22,23,25);1-9,11,16H,10H2,(H,24,25,27)/t22-;17-;2*19-;16-/m11111/s1.

What are the key properties of N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide?

N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 2016.25 g/mol, XLogP of 16.71, 25 rotatable bonds, 7 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;N-(2-morpholin-4-ylethyl)-2-[[(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetyl]amino]-1,3-thiazole-4-carboxamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-3-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-pyridin-4-ylacetamide;(2R)-2-(3-oxo-1H-isoindol-2-yl)-2-phenyl-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 161202651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).