N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

C117H90F4N28O18S6 — CID 161346497

IUPACN-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCc1cc(F)cc(S(=O)c2ccc(CNC(=O)c3cc4cnccc4[nH]3)nc2)c1.O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cn1)c1ccc2nccn2c1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cc2ccncc2o1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cc2cnccc2[nH]1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1ccc2nccn2c1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cnc2nccn2c1
InChIInChI=1S/C21H15F3N4O3S.C21H17FN4O2S.2C19H15N5O3S.C19H14N4O4S.C18H14N6O3S/c22-21(23,24)15-2-1-3-17(10-15)32(30,31)18-6-5-16(26-12-18)11-27-20(29)14-4-7-19-25-8-9-28(19)13-14;1-13-6-15(22)9-18(7-13)29(28)17-3-2-16(24-12-17)11-25-21(27)20-8-14-10-23-5-4-19(14)26-20;25-19(17-8-13-9-20-7-6-16(13)24-17)23-12-18-21-10-15(11-22-18)28(26,27)14-4-2-1-3-5-14;25-19(14-6-7-18-20-8-9-24(18)13-14)23-12-17-21-10-16(11-22-17)28(26,27)15-4-2-1-3-5-15;24-19(16-8-13-6-7-20-11-17(13)27-16)23-12-18-21-9-15(10-22-18)28(25,26)14-4-2-1-3-5-14;25-17(13-8-23-18-19-6-7-24(18)12-13)22-11-16-20-9-15(10-21-16)28(26,27)14-4-2-1-3-5-14/h1-10,12-13H,11H2,(H,27,29);2-10,12,26H,11H2,1H3,(H,25,27);1-11,24H,12H2,(H,23,25);1-11,13H,12H2,(H,23,25);1-11H,12H2,(H,23,24);1-10,12H,11H2,(H,22,25)
InChIKeyVNJCQRWEUUYEKG-UHFFFAOYSA-N
MW2444.58 g/mol
LogP14.68
Rot. Bonds30

About N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 161346497) has the molecular formula C117H90F4N28O18S6 and a molecular weight of 2444.58 g/mol. Its IUPAC name is N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID161346497
Molecular FormulaC117H90F4N28O18S6
Molecular Weight2444.58 g/mol
Exact Mass2442.52
IUPAC NameN-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCc1cc(F)cc(S(=O)c2ccc(CNC(=O)c3cc4cnccc4[nH]3)nc2)c1.O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cn1)c1ccc2nccn2c1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cc2ccncc2o1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cc2cnccc2[nH]1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1ccc2nccn2c1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cnc2nccn2c1
InChIInChI=1S/C21H15F3N4O3S.C21H17FN4O2S.2C19H15N5O3S.C19H14N4O4S.C18H14N6O3S/c22-21(23,24)15-2-1-3-17(10-15)32(30,31)18-6-5-16(26-12-18)11-27-20(29)14-4-7-19-25-8-9-28(19)13-14;1-13-6-15(22)9-18(7-13)29(28)17-3-2-16(24-12-17)11-25-21(27)20-8-14-10-23-5-4-19(14)26-20;25-19(17-8-13-9-20-7-6-16(13)24-17)23-12-18-21-10-15(11-22-18)28(26,27)14-4-2-1-3-5-14;25-19(14-6-7-18-20-8-9-24(18)13-14)23-12-17-21-10-16(11-22-17)28(26,27)15-4-2-1-3-5-15;24-19(16-8-13-6-7-20-11-17(13)27-16)23-12-18-21-9-15(10-22-18)28(25,26)14-4-2-1-3-5-14;25-17(13-8-23-18-19-6-7-24(18)12-13)22-11-16-20-9-15(10-21-16)28(26,27)14-4-2-1-3-5-14/h1-10,12-13H,11H2,(H,27,29);2-10,12,26H,11H2,1H3,(H,25,27);1-11,24H,12H2,(H,23,25);1-11,13H,12H2,(H,23,25);1-11H,12H2,(H,23,24);1-10,12H,11H2,(H,22,25)
InChIKeyVNJCQRWEUUYEKG-UHFFFAOYSA-N
XLogP14.68
TPSA639.45 Ų
H-Bond Donors8
H-Bond Acceptors38
Rotatable Bonds30
Heavy Atoms173
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002444.58
LogP ≤ 514.68
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1038

Analyze N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 161346497) is N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is Cc1cc(F)cc(S(=O)c2ccc(CNC(=O)c3cc4cnccc4[nH]3)nc2)c1.O=C(NCc1ccc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cn1)c1ccc2nccn2c1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cc2ccncc2o1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cc2cnccc2[nH]1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1ccc2nccn2c1.O=C(NCc1ncc(S(=O)(=O)c2ccccc2)cn1)c1cnc2nccn2c1.
What is the InChIKey of N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is VNJCQRWEUUYEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F3N4O3S.C21H17FN4O2S.2C19H15N5O3S.C19H14N4O4S.C18H14N6O3S/c22-21(23,24)15-2-1-3-17(10-15)32(30,31)18-6-5-16(26-12-18)11-27-20(29)14-4-7-19-25-8-9-28(19)13-14;1-13-6-15(22)9-18(7-13)29(28)17-3-2-16(24-12-17)11-25-21(27)20-8-14-10-23-5-4-19(14)26-20;25-19(17-8-13-9-20-7-6-16(13)24-17)23-12-18-21-10-15(11-22-18)28(26,27)14-4-2-1-3-5-14;25-19(14-6-7-18-20-8-9-24(18)13-14)23-12-17-21-10-16(11-22-17)28(26,27)15-4-2-1-3-5-15;24-19(16-8-13-6-7-20-11-17(13)27-16)23-12-18-21-9-15(10-22-18)28(25,26)14-4-2-1-3-5-14;25-17(13-8-23-18-19-6-7-24(18)12-13)22-11-16-20-9-15(10-21-16)28(26,27)14-4-2-1-3-5-14/h1-10,12-13H,11H2,(H,27,29);2-10,12,26H,11H2,1H3,(H,25,27);1-11,24H,12H2,(H,23,25);1-11,13H,12H2,(H,23,25);1-11H,12H2,(H,23,24);1-10,12H,11H2,(H,22,25).
What are the key properties of N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 2444.58 g/mol, XLogP of 14.68, 30 rotatable bonds, 8 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyridine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]imidazo[1,2-a]pyrimidine-6-carboxamide;N-[[5-(benzenesulfonyl)pyrimidin-2-yl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-(3-fluoro-5-methylphenyl)sulfinyl-2-pyridinyl]methyl]-1H-pyrrolo[3,2-c]pyridine-2-carboxamide;N-[[5-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyridinyl]methyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 161346497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).