N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

C103H123F6N21O16S4 — CID 157453599

IUPACN-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
SMILESCC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CC(C)(C)OCC3(C)C)n2)c1.CC(C)Oc1cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)cc(C(F)(F)F)c1.C[C@@H]1CC[C@H](C)N1c1nc(-c2ccc(OC(F)F)nc2)ccc1C(=O)NS(=O)(=O)c1cccc(N)n1.C[C@@H]1CN(c2nc(CCC3CC3)ccc2C(=O)NS(=O)(=O)c2cccc(N)n2)C(C)(C)C1
InChIInChI=1S/C29H36FN5O5S.C28H32F3N5O4S.C23H24F2N6O4S.C23H31N5O3S/c1-18(2)15-39-21-13-19(12-20(30)14-21)23-11-10-22(26(32-23)35-16-29(5,6)40-17-28(35,3)4)27(36)34-41(37,38)25-9-7-8-24(31)33-25;1-16(2)40-20-12-18(11-19(13-20)28(29,30)31)22-10-9-21(25(33-22)36-15-17(3)14-27(36,4)5)26(37)35-41(38,39)24-8-6-7-23(32)34-24;1-13-6-7-14(2)31(13)21-16(22(32)30-36(33,34)20-5-3-4-18(26)29-20)9-10-17(28-21)15-8-11-19(27-12-15)35-23(24)25;1-15-13-23(2,3)28(14-15)21-18(12-11-17(25-21)10-9-16-7-8-16)22(29)27-32(30,31)20-6-4-5-19(24)26-20/h7-14,18H,15-17H2,1-6H3,(H2,31,33)(H,34,36);6-13,16-17H,14-15H2,1-5H3,(H2,32,34)(H,35,37);3-5,8-14,23H,6-7H2,1-2H3,(H2,26,29)(H,30,32);4-6,11-12,15-16H,7-10,13-14H2,1-3H3,(H2,24,26)(H,27,29)/t;17-;13-,14+;15-/m.0.0/s1
InChIKeyBTBWTNSKOILVID-SETMKULOSA-N
MW2153.50 g/mol
LogP16.05
Rot. Bonds29

About N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide

N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (PubChem CID 157453599) has the molecular formula C103H123F6N21O16S4 and a molecular weight of 2153.50 g/mol. Its IUPAC name is N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
PubChem CID157453599
Molecular FormulaC103H123F6N21O16S4
Molecular Weight2153.50 g/mol
Exact Mass2151.82
IUPAC NameN-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
SMILESCC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CC(C)(C)OCC3(C)C)n2)c1.CC(C)Oc1cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)cc(C(F)(F)F)c1.C[C@@H]1CC[C@H](C)N1c1nc(-c2ccc(OC(F)F)nc2)ccc1C(=O)NS(=O)(=O)c1cccc(N)n1.C[C@@H]1CN(c2nc(CCC3CC3)ccc2C(=O)NS(=O)(=O)c2cccc(N)n2)C(C)(C)C1
InChIInChI=1S/C29H36FN5O5S.C28H32F3N5O4S.C23H24F2N6O4S.C23H31N5O3S/c1-18(2)15-39-21-13-19(12-20(30)14-21)23-11-10-22(26(32-23)35-16-29(5,6)40-17-28(35,3)4)27(36)34-41(37,38)25-9-7-8-24(31)33-25;1-16(2)40-20-12-18(11-19(13-20)28(29,30)31)22-10-9-21(25(33-22)36-15-17(3)14-27(36,4)5)26(37)35-41(38,39)24-8-6-7-23(32)34-24;1-13-6-7-14(2)31(13)21-16(22(32)30-36(33,34)20-5-3-4-18(26)29-20)9-10-17(28-21)15-8-11-19(27-12-15)35-23(24)25;1-15-13-23(2,3)28(14-15)21-18(12-11-17(25-21)10-9-16-7-8-16)22(29)27-32(30,31)20-6-4-5-19(24)26-20/h7-14,18H,15-17H2,1-6H3,(H2,31,33)(H,34,36);6-13,16-17H,14-15H2,1-5H3,(H2,32,34)(H,35,37);3-5,8-14,23H,6-7H2,1-2H3,(H2,26,29)(H,30,32);4-6,11-12,15-16H,7-10,13-14H2,1-3H3,(H2,24,26)(H,27,29)/t;17-;13-,14+;15-/m.0.0/s1
InChIKeyBTBWTNSKOILVID-SETMKULOSA-N
XLogP16.05
TPSA522.93 Ų
H-Bond Donors8
H-Bond Acceptors33
Rotatable Bonds29
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002153.50
LogP ≤ 516.05
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1033

Analyze N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?
The IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide (CID 157453599) is N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CC(C)(C)OCC3(C)C)n2)c1.CC(C)Oc1cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3C[C@@H](C)CC3(C)C)n2)cc(C(F)(F)F)c1.C[C@@H]1CC[C@H](C)N1c1nc(-c2ccc(OC(F)F)nc2)ccc1C(=O)NS(=O)(=O)c1cccc(N)n1.C[C@@H]1CN(c2nc(CCC3CC3)ccc2C(=O)NS(=O)(=O)c2cccc(N)n2)C(C)(C)C1.
What is the InChIKey of N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?
The InChIKey is BTBWTNSKOILVID-SETMKULOSA-N. The full InChI is InChI=1S/C29H36FN5O5S.C28H32F3N5O4S.C23H24F2N6O4S.C23H31N5O3S/c1-18(2)15-39-21-13-19(12-20(30)14-21)23-11-10-22(26(32-23)35-16-29(5,6)40-17-28(35,3)4)27(36)34-41(37,38)25-9-7-8-24(31)33-25;1-16(2)40-20-12-18(11-19(13-20)28(29,30)31)22-10-9-21(25(33-22)36-15-17(3)14-27(36,4)5)26(37)35-41(38,39)24-8-6-7-23(32)34-24;1-13-6-7-14(2)31(13)21-16(22(32)30-36(33,34)20-5-3-4-18(26)29-20)9-10-17(28-21)15-8-11-19(27-12-15)35-23(24)25;1-15-13-23(2,3)28(14-15)21-18(12-11-17(25-21)10-9-16-7-8-16)22(29)27-32(30,31)20-6-4-5-19(24)26-20/h7-14,18H,15-17H2,1-6H3,(H2,31,33)(H,34,36);6-13,16-17H,14-15H2,1-5H3,(H2,32,34)(H,35,37);3-5,8-14,23H,6-7H2,1-2H3,(H2,26,29)(H,30,32);4-6,11-12,15-16H,7-10,13-14H2,1-3H3,(H2,24,26)(H,27,29)/t;17-;13-,14+;15-/m.0.0/s1.
What are the key properties of N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide?
N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide has a molecular weight of 2153.50 g/mol, XLogP of 16.05, 29 rotatable bonds, 8 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-2-pyridinyl)sulfonyl]-6-(2-cyclopropylethyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[6-(difluoromethoxy)-3-pyridinyl]-2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2,2,5,5-tetramethylmorpholin-4-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-propan-2-yloxy-5-(trifluoromethyl)phenyl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 157453599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).