4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride

C70H99BCl3F6N13O13S3 — CID 158331657

About 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride

4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride (PubChem CID 158331657) has the molecular formula C70H99BCl3F6N13O13S3 and a molecular weight of 1658.00 g/mol. Its IUPAC name is 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride.

Molecular Properties

• Compound Name: 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride
• PubChem CID: 158331657
• Molecular Formula: C70H99BCl3F6N13O13S3
• Molecular Weight: 1658.00 g/mol
• Exact Mass: 1655.57
• IUPAC Name: 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride
• SMILES: CC(C)S(=O)(=O)Cl.CC(C)S(=O)(=O)Nc1cc(Cl)cc(N2CCOCC2)n1.Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1-c1cc(NS(=O)(=O)C(C)C)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1B1OC(C)(C)C(C)(C)O1.Nc1cc(Cl)cc(N2CCOCC2)n1
• InChI: InChI=1S/C26H34F3N5O4S.C20H28BF3N2O3.C12H18ClN3O3S.C9H12ClN3O.C3H7ClO2S/c1-17(2)39(36,37)32-23-12-20(13-24(31-23)33-8-10-38-11-9-33)22-14-21(5-4-18(22)3)30-25(35)34-7-6-19(16-34)15-26(27,28)29;1-13-6-7-15(10-16(13)21-28-18(2,3)19(4,5)29-21)25-17(27)26-9-8-14(12-26)11-20(22,23)24;1-9(2)20(17,18)15-11-7-10(13)8-12(14-11)16-3-5-19-6-4-16;10-7-5-8(11)12-9(6-7)13-1-3-14-4-2-13;1-3(2)7(4,5)6/h4-5,12-14,17,19H,6-11,15-16H2,1-3H3,(H,30,35)(H,31,32);6-7,10,14H,8-9,11-12H2,1-5H3,(H,25,27);7-9H,3-6H2,1-2H3,(H,14,15);5-6H,1-4H2,(H2,11,12);3H,1-2H3/t19-;14-;;;/m00.../s1
• InChIKey: GQBYAJNFKQTLSJ-CUPKJWGSSA-N
• XLogP: 12.79
• TPSA: 311.72 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 20
• Rotatable Bonds: 16
• Heavy Atoms: 109
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1658.00
LogP ≤ 5	12.79
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride?

The IUPAC name of 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride (CID 158331657) is 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride.

What is the SMILES notation for 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride?

The canonical SMILES for 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride is CC(C)S(=O)(=O)Cl.CC(C)S(=O)(=O)Nc1cc(Cl)cc(N2CCOCC2)n1.Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1-c1cc(NS(=O)(=O)C(C)C)nc(N2CCOCC2)c1.Cc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1B1OC(C)(C)C(C)(C)O1.Nc1cc(Cl)cc(N2CCOCC2)n1.

What is the InChIKey of 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride?

The InChIKey is GQBYAJNFKQTLSJ-CUPKJWGSSA-N. The full InChI is InChI=1S/C26H34F3N5O4S.C20H28BF3N2O3.C12H18ClN3O3S.C9H12ClN3O.C3H7ClO2S/c1-17(2)39(36,37)32-23-12-20(13-24(31-23)33-8-10-38-11-9-33)22-14-21(5-4-18(22)3)30-25(35)34-7-6-19(16-34)15-26(27,28)29;1-13-6-7-15(10-16(13)21-28-18(2,3)19(4,5)29-21)25-17(27)26-9-8-14(12-26)11-20(22,23)24;1-9(2)20(17,18)15-11-7-10(13)8-12(14-11)16-3-5-19-6-4-16;10-7-5-8(11)12-9(6-7)13-1-3-14-4-2-13;1-3(2)7(4,5)6/h4-5,12-14,17,19H,6-11,15-16H2,1-3H3,(H,30,35)(H,31,32);6-7,10,14H,8-9,11-12H2,1-5H3,(H,25,27);7-9H,3-6H2,1-2H3,(H,14,15);5-6H,1-4H2,(H2,11,12);3H,1-2H3/t19-;14-;;;/m00.../s1.

What are the key properties of 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride?

4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride has a molecular weight of 1658.00 g/mol, XLogP of 12.79, 16 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-6-morpholin-4-ylpyridin-2-amine;N-(4-chloro-6-morpholin-4-yl-2-pyridinyl)propane-2-sulfonamide;(3S)-N-[4-methyl-3-[2-morpholin-4-yl-6-(propan-2-ylsulfonylamino)-4-pyridinyl]phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;(3S)-N-[4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-3-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide;propane-2-sulfonyl chloride is sourced from PubChem (CID 158331657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).