3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide

C112H84BrCl2F4N19O13 — CID 160880057

IUPAC3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cc(-c3ccncc3)c[nH]c2=O)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(OCc2ccccc2)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(Br)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(C(F)(F)F)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(Cl)c1Cl.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccccc1F
InChIInChI=1S/C24H19N3O3.C19H18N4O2.C18H12F3N3O2.C17H12BrN3O2.C17H11Cl2N3O2.C17H12FN3O2/c28-23(19-6-8-21(9-7-19)30-16-17-4-2-1-3-5-17)27-22-14-20(15-26-24(22)29)18-10-12-25-13-11-18;1-23(2)16-5-3-14(4-6-16)18(24)22-17-11-15(12-21-19(17)25)13-7-9-20-10-8-13;19-18(20,21)14-3-1-2-12(8-14)16(25)24-15-9-13(10-23-17(15)26)11-4-6-22-7-5-11;18-14-3-1-2-12(8-14)16(22)21-15-9-13(10-20-17(15)23)11-4-6-19-7-5-11;18-13-3-1-2-12(15(13)19)16(23)22-14-8-11(9-21-17(14)24)10-4-6-20-7-5-10;18-14-4-2-1-3-13(14)16(22)21-15-9-12(10-20-17(15)23)11-5-7-19-8-6-11/h1-15H,16H2,(H,26,29)(H,27,28);3-12H,1-2H3,(H,21,25)(H,22,24);1-10H,(H,23,26)(H,24,25);1-10H,(H,20,23)(H,21,22);1-9H,(H,21,24)(H,22,23);1-10H,(H,20,23)(H,21,22)
InChIKeySMXKGSTZIPPHAM-UHFFFAOYSA-N
MW2130.83 g/mol
LogP21.01
Rot. Bonds22

About 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide

3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide (PubChem CID 160880057) has the molecular formula C112H84BrCl2F4N19O13 and a molecular weight of 2130.83 g/mol. Its IUPAC name is 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide
PubChem CID160880057
Molecular FormulaC112H84BrCl2F4N19O13
Molecular Weight2130.83 g/mol
Exact Mass2127.50
IUPAC Name3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2cc(-c3ccncc3)c[nH]c2=O)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(OCc2ccccc2)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(Br)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(C(F)(F)F)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(Cl)c1Cl.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccccc1F
InChIInChI=1S/C24H19N3O3.C19H18N4O2.C18H12F3N3O2.C17H12BrN3O2.C17H11Cl2N3O2.C17H12FN3O2/c28-23(19-6-8-21(9-7-19)30-16-17-4-2-1-3-5-17)27-22-14-20(15-26-24(22)29)18-10-12-25-13-11-18;1-23(2)16-5-3-14(4-6-16)18(24)22-17-11-15(12-21-19(17)25)13-7-9-20-10-8-13;19-18(20,21)14-3-1-2-12(8-14)16(25)24-15-9-13(10-23-17(15)26)11-4-6-22-7-5-11;18-14-3-1-2-12(8-14)16(22)21-15-9-13(10-20-17(15)23)11-4-6-19-7-5-11;18-13-3-1-2-12(15(13)19)16(23)22-14-8-11(9-21-17(14)24)10-4-6-20-7-5-10;18-14-4-2-1-3-13(14)16(22)21-15-9-12(10-20-17(15)23)11-5-7-19-8-6-11/h1-15H,16H2,(H,26,29)(H,27,28);3-12H,1-2H3,(H,21,25)(H,22,24);1-10H,(H,23,26)(H,24,25);1-10H,(H,20,23)(H,21,22);1-9H,(H,21,24)(H,22,23);1-10H,(H,20,23)(H,21,22)
InChIKeySMXKGSTZIPPHAM-UHFFFAOYSA-N
XLogP21.01
TPSA461.57 Ų
H-Bond Donors12
H-Bond Acceptors20
Rotatable Bonds22
Heavy Atoms151
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002130.83
LogP ≤ 521.01
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1020

Analyze 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide?
The IUPAC name of 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide (CID 160880057) is 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide?
The canonical SMILES for 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide is CN(C)c1ccc(C(=O)Nc2cc(-c3ccncc3)c[nH]c2=O)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(OCc2ccccc2)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(Br)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(C(F)(F)F)c1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1cccc(Cl)c1Cl.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccccc1F.
What is the InChIKey of 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide?
The InChIKey is SMXKGSTZIPPHAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3.C19H18N4O2.C18H12F3N3O2.C17H12BrN3O2.C17H11Cl2N3O2.C17H12FN3O2/c28-23(19-6-8-21(9-7-19)30-16-17-4-2-1-3-5-17)27-22-14-20(15-26-24(22)29)18-10-12-25-13-11-18;1-23(2)16-5-3-14(4-6-16)18(24)22-17-11-15(12-21-19(17)25)13-7-9-20-10-8-13;19-18(20,21)14-3-1-2-12(8-14)16(25)24-15-9-13(10-23-17(15)26)11-4-6-22-7-5-11;18-14-3-1-2-12(8-14)16(22)21-15-9-13(10-20-17(15)23)11-4-6-19-7-5-11;18-13-3-1-2-12(15(13)19)16(23)22-14-8-11(9-21-17(14)24)10-4-6-20-7-5-10;18-14-4-2-1-3-13(14)16(22)21-15-9-12(10-20-17(15)23)11-5-7-19-8-6-11/h1-15H,16H2,(H,26,29)(H,27,28);3-12H,1-2H3,(H,21,25)(H,22,24);1-10H,(H,23,26)(H,24,25);1-10H,(H,20,23)(H,21,22);1-9H,(H,21,24)(H,22,23);1-10H,(H,20,23)(H,21,22).
What are the key properties of 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide?
3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide has a molecular weight of 2130.83 g/mol, XLogP of 21.01, 22 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2,3-dichloro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-(dimethylamino)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;2-fluoro-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenylmethoxybenzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 160880057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).