1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide

C98H96N12O10S — CID 162285719

IUPAC1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide
SMILESCC1=CC(C)=NC(=O)C1CNC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12.Cc1cc(C)c(CNC(=O)c2c(C)n(-c3ccccc3)c3ccccc23)c(=O)[nH]1.Cc1cc(C)c(CNC(=O)c2c(C)n(-c3ccccc3C)c3ccccc23)c(=O)[nH]1.Cc1cc(C)c(CNC(=O)c2c(C)n(C(C)c3ccccc3)c3ccccc23)c(=O)[nH]1
InChIInChI=1S/C26H27N3O2.C25H25N3O2.C24H23N3O2.C23H21N3O4S/c1-16-14-17(2)28-25(30)22(16)15-27-26(31)24-19(4)29(23-13-9-8-12-21(23)24)18(3)20-10-6-5-7-11-20;1-15-9-5-7-11-21(15)28-18(4)23(19-10-6-8-12-22(19)28)25(30)26-14-20-16(2)13-17(3)27-24(20)29;1-15-13-16(2)26-23(28)20(15)14-25-24(29)22-17(3)27(18-9-5-4-6-10-18)21-12-8-7-11-19(21)22;1-15-12-16(2)25-23(28)19(15)13-24-22(27)20-14-26(21-11-7-6-10-18(20)21)31(29,30)17-8-4-3-5-9-17/h5-14,18H,15H2,1-4H3,(H,27,31)(H,28,30);5-13H,14H2,1-4H3,(H,26,30)(H,27,29);4-13H,14H2,1-3H3,(H,25,29)(H,26,28);3-12,14,19H,13H2,1-2H3,(H,24,27)
InChIKeyIYJFNSSKFUESNN-UHFFFAOYSA-N
MW1633.99 g/mol
LogP16.62
Rot. Bonds18

About 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide

1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide (PubChem CID 162285719) has the molecular formula C98H96N12O10S and a molecular weight of 1633.99 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide
PubChem CID162285719
Molecular FormulaC98H96N12O10S
Molecular Weight1633.99 g/mol
Exact Mass1632.71
IUPAC Name1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide
SMILESCC1=CC(C)=NC(=O)C1CNC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12.Cc1cc(C)c(CNC(=O)c2c(C)n(-c3ccccc3)c3ccccc23)c(=O)[nH]1.Cc1cc(C)c(CNC(=O)c2c(C)n(-c3ccccc3C)c3ccccc23)c(=O)[nH]1.Cc1cc(C)c(CNC(=O)c2c(C)n(C(C)c3ccccc3)c3ccccc23)c(=O)[nH]1
InChIInChI=1S/C26H27N3O2.C25H25N3O2.C24H23N3O2.C23H21N3O4S/c1-16-14-17(2)28-25(30)22(16)15-27-26(31)24-19(4)29(23-13-9-8-12-21(23)24)18(3)20-10-6-5-7-11-20;1-15-9-5-7-11-21(15)28-18(4)23(19-10-6-8-12-22(19)28)25(30)26-14-20-16(2)13-17(3)27-24(20)29;1-15-13-16(2)26-23(28)20(15)14-25-24(29)22-17(3)27(18-9-5-4-6-10-18)21-12-8-7-11-19(21)22;1-15-12-16(2)25-23(28)19(15)13-24-22(27)20-14-26(21-11-7-6-10-18(20)21)31(29,30)17-8-4-3-5-9-17/h5-14,18H,15H2,1-4H3,(H,27,31)(H,28,30);5-13H,14H2,1-4H3,(H,26,30)(H,27,29);4-13H,14H2,1-3H3,(H,25,29)(H,26,28);3-12,14,19H,13H2,1-2H3,(H,24,27)
InChIKeyIYJFNSSKFUESNN-UHFFFAOYSA-N
XLogP16.62
TPSA298.27 Ų
H-Bond Donors7
H-Bond Acceptors14
Rotatable Bonds18
Heavy Atoms121
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001633.99
LogP ≤ 516.62
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1014

Analyze 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide with MolForge

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Related Compounds

N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide
CID 71661182
N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-2-methyl-1-[1-(1-methylpyrazol-4-yl)ethyl]indole-3-carboxamide
CID 122362643
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-propan-2-ylindole-3-carboxamide
CID 122186508
N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-(oxan-4-yl)ethyl]indole-3-carboxamide
CID 122362641
2-cyano-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-(1-phenylethyl)indole-3-carboxamide
CID 71715864
1-[(1S)-1-[1-(azetidin-3-yl)piperidin-4-yl]ethyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methylindole-3-carboxamide;hydrochloride
CID 126736254
1-(1-cyclopentyl-1-oxopropan-2-yl)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methylindole-3-carboxamide
CID 71715065
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-[(2R)-1-methoxypropan-2-yl]-2-methylindole-3-carboxamide
CID 122186509
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-[(1R)-1-[4-[(3-methyloxetan-3-yl)amino]cyclohexyl]ethyl]indole-3-carboxamide
CID 142589863
1-[1-(1-ethylsulfonylpiperidin-4-yl)ethyl]-2-methyl-N-[(6-methyl-4-methylsulfanyl-2-oxo-1H-pyridin-3-yl)methyl]indole-3-carboxamide
CID 166666466
1-(1-cyclohexylethyl)-N-[(4-methoxy-6-methyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methylindole-3-carboxamide
CID 144683606
1-[1-[(3R,4R)-3-fluoro-1-methylpiperidin-4-yl]ethyl]-2-methyl-N-[(6-methyl-4-methylsulfanyl-2-oxo-1H-pyridin-3-yl)methyl]indole-3-carboxamide
CID 166666458

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide (CID 162285719) is 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide is CC1=CC(C)=NC(=O)C1CNC(=O)c1cn(S(=O)(=O)c2ccccc2)c2ccccc12.Cc1cc(C)c(CNC(=O)c2c(C)n(-c3ccccc3)c3ccccc23)c(=O)[nH]1.Cc1cc(C)c(CNC(=O)c2c(C)n(-c3ccccc3C)c3ccccc23)c(=O)[nH]1.Cc1cc(C)c(CNC(=O)c2c(C)n(C(C)c3ccccc3)c3ccccc23)c(=O)[nH]1.
What is the InChIKey of 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide?
The InChIKey is IYJFNSSKFUESNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O2.C25H25N3O2.C24H23N3O2.C23H21N3O4S/c1-16-14-17(2)28-25(30)22(16)15-27-26(31)24-19(4)29(23-13-9-8-12-21(23)24)18(3)20-10-6-5-7-11-20;1-15-9-5-7-11-21(15)28-18(4)23(19-10-6-8-12-22(19)28)25(30)26-14-20-16(2)13-17(3)27-24(20)29;1-15-13-16(2)26-23(28)20(15)14-25-24(29)22-17(3)27(18-9-5-4-6-10-18)21-12-8-7-11-19(21)22;1-15-12-16(2)25-23(28)19(15)13-24-22(27)20-14-26(21-11-7-6-10-18(20)21)31(29,30)17-8-4-3-5-9-17/h5-14,18H,15H2,1-4H3,(H,27,31)(H,28,30);5-13H,14H2,1-4H3,(H,26,30)(H,27,29);4-13H,14H2,1-3H3,(H,25,29)(H,26,28);3-12,14,19H,13H2,1-2H3,(H,24,27).
What are the key properties of 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide?
1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide has a molecular weight of 1633.99 g/mol, XLogP of 16.62, 18 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(2-methylphenyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-(1-phenylethyl)indole-3-carboxamide;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-methyl-1-phenylindole-3-carboxamide is sourced from PubChem (CID 162285719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).