N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one

C99H98F4N22O13S3 — CID 160557093

IUPACN-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one
SMILESCC(=O)Cc1cc(-c2cnc3cn[nH]c3c2)ccn1.CC(=O)Cc1cc(-c2cncc(S(=O)(=O)N3CCC(F)(F)C3)c2)ccn1.CC(=O)Nc1cc(-c2cnc(C)c(CC(=O)c3ccc(F)cc3F)c2)ccn1.CC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)N(C)C)c2)ccn1.CCN(CC)S(=O)(=O)c1cncc(-c2ccnc(NC(C)=O)c2)c1.O=C(Cc1cc(-c2cnc3c(c2)C=NC3)ccn1)C1CC1
InChIInChI=1S/C21H17F2N3O2.C17H17F2N3O3S.C17H15N3O.C16H20N4O3S.C14H17N5O3S.C14H12N4O/c1-12-15(8-20(28)18-4-3-17(22)10-19(18)23)7-16(11-25-12)14-5-6-24-21(9-14)26-13(2)27;1-12(23)6-15-7-13(2-4-21-15)14-8-16(10-20-9-14)26(24,25)22-5-3-17(18,19)11-22;21-17(11-1-2-11)7-15-6-12(3-4-19-15)13-5-14-8-18-10-16(14)20-9-13;1-4-20(5-2)24(22,23)15-8-14(10-17-11-15)13-6-7-18-16(9-13)19-12(3)21;1-9(20)18-13-7-10(4-5-16-13)11-6-12(14(15)17-8-11)23(21,22)19(2)3;1-9(19)4-12-5-10(2-3-15-12)11-6-13-14(16-7-11)8-17-18-13/h3-7,9-11H,8H2,1-2H3,(H,24,26,27);2,4,7-10H,3,5-6,11H2,1H3;3-6,8-9,11H,1-2,7,10H2;6-11H,4-5H2,1-3H3,(H,18,19,21);4-8H,1-3H3,(H2,15,17)(H,16,18,20);2-3,5-8H,4H2,1H3,(H,17,18)
InChIKeyQYVFHVDVOFNHJE-UHFFFAOYSA-N
MW1976.21 g/mol
LogP14.23
Rot. Bonds27

About N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one

N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one (PubChem CID 160557093) has the molecular formula C99H98F4N22O13S3 and a molecular weight of 1976.21 g/mol. Its IUPAC name is N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one.

Molecular Properties

Compound NameN-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one
PubChem CID160557093
Molecular FormulaC99H98F4N22O13S3
Molecular Weight1976.21 g/mol
Exact Mass1974.68
IUPAC NameN-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one
SMILESCC(=O)Cc1cc(-c2cnc3cn[nH]c3c2)ccn1.CC(=O)Cc1cc(-c2cncc(S(=O)(=O)N3CCC(F)(F)C3)c2)ccn1.CC(=O)Nc1cc(-c2cnc(C)c(CC(=O)c3ccc(F)cc3F)c2)ccn1.CC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)N(C)C)c2)ccn1.CCN(CC)S(=O)(=O)c1cncc(-c2ccnc(NC(C)=O)c2)c1.O=C(Cc1cc(-c2cnc3c(c2)C=NC3)ccn1)C1CC1
InChIInChI=1S/C21H17F2N3O2.C17H17F2N3O3S.C17H15N3O.C16H20N4O3S.C14H17N5O3S.C14H12N4O/c1-12-15(8-20(28)18-4-3-17(22)10-19(18)23)7-16(11-25-12)14-5-6-24-21(9-14)26-13(2)27;1-12(23)6-15-7-13(2-4-21-15)14-8-16(10-20-9-14)26(24,25)22-5-3-17(18,19)11-22;21-17(11-1-2-11)7-15-6-12(3-4-19-15)13-5-14-8-18-10-16(14)20-9-13;1-4-20(5-2)24(22,23)15-8-14(10-17-11-15)13-6-7-18-16(9-13)19-12(3)21;1-9(20)18-13-7-10(4-5-16-13)11-6-12(14(15)17-8-11)23(21,22)19(2)3;1-9(19)4-12-5-10(2-3-15-12)11-6-13-14(16-7-11)8-17-18-13/h3-7,9-11H,8H2,1-2H3,(H,24,26,27);2,4,7-10H,3,5-6,11H2,1H3;3-6,8-9,11H,1-2,7,10H2;6-11H,4-5H2,1-3H3,(H,18,19,21);4-8H,1-3H3,(H2,15,17)(H,16,18,20);2-3,5-8H,4H2,1H3,(H,17,18)
InChIKeyQYVFHVDVOFNHJE-UHFFFAOYSA-N
XLogP14.23
TPSA489.46 Ų
H-Bond Donors5
H-Bond Acceptors28
Rotatable Bonds27
Heavy Atoms141
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001976.21
LogP ≤ 514.23
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1028

Analyze N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one with MolForge

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Launch Full Analysis

Related Compounds

N-[4-[5-(azetidin-1-ylsulfonyl)-3-pyridinyl]-2-pyridinyl]acetamide
CID 118293550
N-[2-methyl-5-[2-(2-oxopropyl)-4-pyridinyl]-3-pyridinyl]pyrrolidine-1-sulfonamide
CID 152861408
1-[4-(5-pyrrolidin-1-ylsulfonyl-7H-cyclopenta[b]pyridin-3-yl)-2-pyridinyl]propan-2-one
CID 159227268
[5-(2-acetamido-4-pyridinyl)-2-methyl-3-pyridinyl] N,N-dimethylsulfamate
CID 123249562
N-[4-[5-(1-bicyclo[2.1.0]pentanylsulfamoyl)-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide
CID 123524378
N-[2,4-dimethyl-5-[2-(2-oxopropyl)-4-pyridinyl]-3-pyridinyl]-2,4-difluorobenzenesulfonamide
CID 149427022
N-[4-[5-[benzenesulfonyl(methyl)amino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide
CID 118293459
N-[3-(diethylsulfamoyl)phenyl]-2,4-difluorobenzamide
CID 7760043
N-[4-[6-chloro-5-[(2-fluoro-4-methylphenyl)sulfonylmethyl]-4-methyl-3-pyridinyl]-2-pyridinyl]cyclopropanecarboxamide;N-[4-[6-chloro-5-[(2-fluoro-4-methylphenyl)sulfonylmethyl]-4-methyl-3-pyridinyl]-2-pyridinyl]-2-methylpyrimidin-4-amine;2-fluoro-4-methyl-N-[2-methyl-5-[2-(2-oxopropyl)-4-pyridinyl]-3-pyridinyl]benzenesulfonamide;methane
CID 158181315
2,4-difluoro-N-[2-(methylamino)-5-[2-(2-oxopropyl)-4-pyridinyl]-3-pyridinyl]benzenesulfonamide
CID 161390016
N-[4-[5-(1-adamantylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
CID 118249294
5-bromo-2-methylpyridin-3-amine;2-(5-bromo-2-methyl-3-pyridinyl)-1-(3,3-difluoroazetidin-1-yl)ethanone;2-[5-[2-[(2-cyclopropylpyrimidin-4-yl)amino]-4-pyridinyl]-2-methyl-3-pyridinyl]-1-(3,3-difluorocyclobutyl)ethanone;2-cyclopropyl-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]pyrimidin-4-amine;3,3-difluoroazetidine
CID 157149246

Frequently Asked Questions

What is the IUPAC name of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one?
The IUPAC name of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one (CID 160557093) is N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one.
What is the SMILES notation for N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one?
The canonical SMILES for N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one is CC(=O)Cc1cc(-c2cnc3cn[nH]c3c2)ccn1.CC(=O)Cc1cc(-c2cncc(S(=O)(=O)N3CCC(F)(F)C3)c2)ccn1.CC(=O)Nc1cc(-c2cnc(C)c(CC(=O)c3ccc(F)cc3F)c2)ccn1.CC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)N(C)C)c2)ccn1.CCN(CC)S(=O)(=O)c1cncc(-c2ccnc(NC(C)=O)c2)c1.O=C(Cc1cc(-c2cnc3c(c2)C=NC3)ccn1)C1CC1.
What is the InChIKey of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one?
The InChIKey is QYVFHVDVOFNHJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F2N3O2.C17H17F2N3O3S.C17H15N3O.C16H20N4O3S.C14H17N5O3S.C14H12N4O/c1-12-15(8-20(28)18-4-3-17(22)10-19(18)23)7-16(11-25-12)14-5-6-24-21(9-14)26-13(2)27;1-12(23)6-15-7-13(2-4-21-15)14-8-16(10-20-9-14)26(24,25)22-5-3-17(18,19)11-22;21-17(11-1-2-11)7-15-6-12(3-4-19-15)13-5-14-8-18-10-16(14)20-9-13;1-4-20(5-2)24(22,23)15-8-14(10-17-11-15)13-6-7-18-16(9-13)19-12(3)21;1-9(20)18-13-7-10(4-5-16-13)11-6-12(14(15)17-8-11)23(21,22)19(2)3;1-9(19)4-12-5-10(2-3-15-12)11-6-13-14(16-7-11)8-17-18-13/h3-7,9-11H,8H2,1-2H3,(H,24,26,27);2,4,7-10H,3,5-6,11H2,1H3;3-6,8-9,11H,1-2,7,10H2;6-11H,4-5H2,1-3H3,(H,18,19,21);4-8H,1-3H3,(H2,15,17)(H,16,18,20);2-3,5-8H,4H2,1H3,(H,17,18).
What are the key properties of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one?
N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one has a molecular weight of 1976.21 g/mol, XLogP of 14.23, 27 rotatable bonds, 5 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;1-cyclopropyl-2-[4-(7H-pyrrolo[3,4-b]pyridin-3-yl)-2-pyridinyl]ethanone;N-[4-[5-(diethylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide;N-[4-[5-[2-(2,4-difluorophenyl)-2-oxoethyl]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide;1-[4-[5-(3,3-difluoropyrrolidin-1-yl)sulfonyl-3-pyridinyl]-2-pyridinyl]propan-2-one;1-[4-(1H-pyrazolo[4,5-b]pyridin-6-yl)-2-pyridinyl]propan-2-one is sourced from PubChem (CID 160557093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).