2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide

C162H175F8N31O23 — CID 158392388

IUPAC2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
SMILESCCC(F)(F)c1cc(C(=O)Nc2cnc(C)c(-c3cc(C4COCCO4)nc(N4CCOCC4)c3)c2)ccn1.COc1ncc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1ccnc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(C)(C)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(C)(F)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C3CC3)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1
InChIInChI=1S/C28H31F2N5O4.C28H32FN5O4.C28H31N5O4.C27H29F2N5O4.C26H26F3N5O4.C25H26N6O3/c1-3-28(29,30)25-13-19(4-5-31-25)27(36)33-21-15-22(18(2)32-16-21)20-12-23(24-17-38-10-11-39-24)34-26(14-20)35-6-8-37-9-7-35;1-18-22(15-21(16-31-18)32-27(35)19-4-5-30-25(13-19)28(2,3)29)20-12-23(24-17-37-10-11-38-24)33-26(14-20)34-6-8-36-9-7-34;1-18-23(15-22(16-30-18)31-28(34)20-4-5-29-24(12-20)19-2-3-19)21-13-25(26-17-36-10-11-37-26)32-27(14-21)33-6-8-35-9-7-33;1-17-21(14-20(15-31-17)32-26(35)18-3-4-30-24(12-18)27(2,28)29)19-11-22(23-16-37-9-10-38-23)33-25(13-19)34-5-7-36-8-6-34;1-16-20(13-19(14-31-16)32-25(35)17-2-3-30-23(11-17)26(27,28)29)18-10-21(22-15-37-8-9-38-22)33-24(12-18)34-4-6-36-7-5-34;1-25(2,16-26)21-12-18(5-6-27-21)23(32)30-19-14-20(24(33-3)29-15-19)17-4-7-28-22(13-17)31-8-10-34-11-9-31/h4-5,12-16,24H,3,6-11,17H2,1-2H3,(H,33,36);4-5,12-16,24H,6-11,17H2,1-3H3,(H,32,35);4-5,12-16,19,26H,2-3,6-11,17H2,1H3,(H,31,34);3-4,11-15,23H,5-10,16H2,1-2H3,(H,32,35);2-3,10-14,22H,4-9,15H2,1H3,(H,32,35);4-7,12-15H,8-11H2,1-3H3,(H,30,32)
InChIKeyGXCUXJLUMJKVJF-UHFFFAOYSA-N
MW3076.36 g/mol
LogP24.27
Rot. Bonds36

About 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide

2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide (PubChem CID 158392388) has the molecular formula C162H175F8N31O23 and a molecular weight of 3076.36 g/mol. Its IUPAC name is 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
PubChem CID158392388
Molecular FormulaC162H175F8N31O23
Molecular Weight3076.36 g/mol
Exact Mass3074.33
IUPAC Name2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide
SMILESCCC(F)(F)c1cc(C(=O)Nc2cnc(C)c(-c3cc(C4COCCO4)nc(N4CCOCC4)c3)c2)ccn1.COc1ncc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1ccnc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(C)(C)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(C)(F)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C3CC3)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1
InChIInChI=1S/C28H31F2N5O4.C28H32FN5O4.C28H31N5O4.C27H29F2N5O4.C26H26F3N5O4.C25H26N6O3/c1-3-28(29,30)25-13-19(4-5-31-25)27(36)33-21-15-22(18(2)32-16-21)20-12-23(24-17-38-10-11-39-24)34-26(14-20)35-6-8-37-9-7-35;1-18-22(15-21(16-31-18)32-27(35)19-4-5-30-25(13-19)28(2,3)29)20-12-23(24-17-37-10-11-38-24)33-26(14-20)34-6-8-36-9-7-34;1-18-23(15-22(16-30-18)31-28(34)20-4-5-29-24(12-20)19-2-3-19)21-13-25(26-17-36-10-11-37-26)32-27(14-21)33-6-8-35-9-7-33;1-17-21(14-20(15-31-17)32-26(35)18-3-4-30-24(12-18)27(2,28)29)19-11-22(23-16-37-9-10-38-23)33-25(13-19)34-5-7-36-8-6-34;1-16-20(13-19(14-31-16)32-25(35)17-2-3-30-23(11-17)26(27,28)29)18-10-21(22-15-37-8-9-38-22)33-24(12-18)34-4-6-36-7-5-34;1-25(2,16-26)21-12-18(5-6-27-21)23(32)30-19-14-20(24(33-3)29-15-19)17-4-7-28-22(13-17)31-8-10-34-11-9-31/h4-5,12-16,24H,3,6-11,17H2,1-2H3,(H,33,36);4-5,12-16,24H,6-11,17H2,1-3H3,(H,32,35);4-5,12-16,19,26H,2-3,6-11,17H2,1H3,(H,31,34);3-4,11-15,23H,5-10,16H2,1-2H3,(H,32,35);2-3,10-14,22H,4-9,15H2,1H3,(H,32,35);4-7,12-15H,8-11H2,1-3H3,(H,30,32)
InChIKeyGXCUXJLUMJKVJF-UHFFFAOYSA-N
XLogP24.27
TPSA606.76 Ų
H-Bond Donors6
H-Bond Acceptors48
Rotatable Bonds36
Heavy Atoms224
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003076.36
LogP ≤ 524.27
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1048

Analyze 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-ylpyridin-4-yl]-6-methylpyridin-3-yl]pyridine-4-carboxamide
CID 117610005
N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-ylpyridin-4-yl]-6-methylpyridin-3-yl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 117610085
2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide
CID 86297277
2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-ylpyridin-4-yl]-6-methylpyridin-3-yl]pyridine-4-carboxamide
CID 117609736
2-(1,1-difluoroethyl)-N-[5-(5-ethoxy-6-morpholin-4-ylpyridin-2-yl)-6-methylpyridin-3-yl]pyridine-4-carboxamide
CID 117610054
N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide
CID 117610092
2-cyclopropyl-N-[5-(2-ethoxy-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 117610041
2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 117610059
2-(2-cyanopropan-2-yl)-N-[5-(2-ethoxy-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 117610053
N-[6-methyl-5-[6-[methyl-[[4-[5-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]pyridin-3-yl]-2-[(3S)-oxolan-3-yl]oxypyridin-3-yl]morpholin-2-yl]methyl]amino]-5-morpholin-4-ylpyridin-3-yl]pyridin-3-yl]-3-(trifluoromethyl)benzamide
CID 130425556
N-[5-[6-[[4-[2-[1-[4-[2-(2-cyanopropan-2-yl)-5-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]pyridin-3-yl]pyridin-3-yl]morpholin-2-yl]azetidin-3-yl]oxy-5-[2-methyl-5-[[3-(trifluoromethyl)benzoyl]amino]pyridin-3-yl]pyridin-3-yl]morpholin-2-yl]methoxy]-5-morpholin-4-ylpyridin-3-yl]-6-methylpyridin-3-yl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 130425796
2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-piperidin-1-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 134379383

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide (CID 158392388) is 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide is CCC(F)(F)c1cc(C(=O)Nc2cnc(C)c(-c3cc(C4COCCO4)nc(N4CCOCC4)c3)c2)ccn1.COc1ncc(NC(=O)c2ccnc(C(C)(C)C#N)c2)cc1-c1ccnc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(C)(C)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(C)(F)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccnc(C3CC3)c2)cc1-c1cc(C2COCCO2)nc(N2CCOCC2)c1.
What is the InChIKey of 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide?
The InChIKey is GXCUXJLUMJKVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H31F2N5O4.C28H32FN5O4.C28H31N5O4.C27H29F2N5O4.C26H26F3N5O4.C25H26N6O3/c1-3-28(29,30)25-13-19(4-5-31-25)27(36)33-21-15-22(18(2)32-16-21)20-12-23(24-17-38-10-11-39-24)34-26(14-20)35-6-8-37-9-7-35;1-18-22(15-21(16-31-18)32-27(35)19-4-5-30-25(13-19)28(2,3)29)20-12-23(24-17-37-10-11-38-24)33-26(14-20)34-6-8-36-9-7-34;1-18-23(15-22(16-30-18)31-28(34)20-4-5-29-24(12-20)19-2-3-19)21-13-25(26-17-36-10-11-37-26)32-27(14-21)33-6-8-35-9-7-33;1-17-21(14-20(15-31-17)32-26(35)18-3-4-30-24(12-18)27(2,28)29)19-11-22(23-16-37-9-10-38-23)33-25(13-19)34-5-7-36-8-6-34;1-16-20(13-19(14-31-16)32-25(35)17-2-3-30-23(11-17)26(27,28)29)18-10-21(22-15-37-8-9-38-22)33-24(12-18)34-4-6-36-7-5-34;1-25(2,16-26)21-12-18(5-6-27-21)23(32)30-19-14-20(24(33-3)29-15-19)17-4-7-28-22(13-17)31-8-10-34-11-9-31/h4-5,12-16,24H,3,6-11,17H2,1-2H3,(H,33,36);4-5,12-16,24H,6-11,17H2,1-3H3,(H,32,35);4-5,12-16,19,26H,2-3,6-11,17H2,1H3,(H,31,34);3-4,11-15,23H,5-10,16H2,1-2H3,(H,32,35);2-3,10-14,22H,4-9,15H2,1H3,(H,32,35);4-7,12-15H,8-11H2,1-3H3,(H,30,32).
What are the key properties of 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide?
2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide has a molecular weight of 3076.36 g/mol, XLogP of 24.27, 36 rotatable bonds, 6 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanopropan-2-yl)-N-[6-methoxy-5-(2-morpholin-4-yl-4-pyridinyl)-3-pyridinyl]pyridine-4-carboxamide;2-cyclopropyl-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoroethyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;2-(1,1-difluoropropyl)-N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(2-fluoropropan-2-yl)pyridine-4-carboxamide;N-[5-[2-(1,4-dioxan-2-yl)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-2-(trifluoromethyl)pyridine-4-carboxamide is sourced from PubChem (CID 158392388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).