4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide

C122H105BrN18O14 — CID 157129733

IUPAC4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(C(=O)Nc2cc(-c3ccncc3)c[nH]c2=O)cc1.O=C(CCc1ccccc1)Nc1cc(-c2ccncc2)c[nH]c1=O.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)C1C[C@H]1c1ccccc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(Br)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(C2CCCCC2)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C23H17N3O3.C23H23N3O2.C20H19N3O3.C20H17N3O2.C19H17N3O2.C17H12BrN3O2/c27-22(17-6-8-20(9-7-17)29-19-4-2-1-3-5-19)26-21-14-18(15-25-23(21)28)16-10-12-24-13-11-16;27-22(19-8-6-17(7-9-19)16-4-2-1-3-5-16)26-21-14-20(15-25-23(21)28)18-10-12-24-13-11-18;1-13(2)26-17-5-3-15(4-6-17)19(24)23-18-11-16(12-22-20(18)25)14-7-9-21-10-8-14;24-19(17-11-16(17)14-4-2-1-3-5-14)23-18-10-15(12-22-20(18)25)13-6-8-21-9-7-13;23-18(7-6-14-4-2-1-3-5-14)22-17-12-16(13-21-19(17)24)15-8-10-20-11-9-15;18-14-3-1-12(2-4-14)16(22)21-15-9-13(10-20-17(15)23)11-5-7-19-8-6-11/h1-15H,(H,25,28)(H,26,27);6-16H,1-5H2,(H,25,28)(H,26,27);3-13H,1-2H3,(H,22,25)(H,23,24);1-10,12,16-17H,11H2,(H,22,25)(H,23,24);1-5,8-13H,6-7H2,(H,21,24)(H,22,23);1-10H,(H,20,23)(H,21,22)/t;;;16-,17?;;/m...0../s1
InChIKeyAIXPINQLFZVXMM-JSLWTDOJSA-N
MW2127.20 g/mol
LogP22.33
Rot. Bonds26

About 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide

4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide (PubChem CID 157129733) has the molecular formula C122H105BrN18O14 and a molecular weight of 2127.20 g/mol. Its IUPAC name is 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide.

Molecular Properties

Compound Name4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide
PubChem CID157129733
Molecular FormulaC122H105BrN18O14
Molecular Weight2127.20 g/mol
Exact Mass2124.72
IUPAC Name4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(C(=O)Nc2cc(-c3ccncc3)c[nH]c2=O)cc1.O=C(CCc1ccccc1)Nc1cc(-c2ccncc2)c[nH]c1=O.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)C1C[C@H]1c1ccccc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(Br)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(C2CCCCC2)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C23H17N3O3.C23H23N3O2.C20H19N3O3.C20H17N3O2.C19H17N3O2.C17H12BrN3O2/c27-22(17-6-8-20(9-7-17)29-19-4-2-1-3-5-19)26-21-14-18(15-25-23(21)28)16-10-12-24-13-11-16;27-22(19-8-6-17(7-9-19)16-4-2-1-3-5-16)26-21-14-20(15-25-23(21)28)18-10-12-24-13-11-18;1-13(2)26-17-5-3-15(4-6-17)19(24)23-18-11-16(12-22-20(18)25)14-7-9-21-10-8-14;24-19(17-11-16(17)14-4-2-1-3-5-14)23-18-10-15(12-22-20(18)25)13-6-8-21-9-7-13;23-18(7-6-14-4-2-1-3-5-14)22-17-12-16(13-21-19(17)24)15-8-10-20-11-9-15;18-14-3-1-12(2-4-14)16(22)21-15-9-13(10-20-17(15)23)11-5-7-19-8-6-11/h1-15H,(H,25,28)(H,26,27);6-16H,1-5H2,(H,25,28)(H,26,27);3-13H,1-2H3,(H,22,25)(H,23,24);1-10,12,16-17H,11H2,(H,22,25)(H,23,24);1-5,8-13H,6-7H2,(H,21,24)(H,22,23);1-10H,(H,20,23)(H,21,22)/t;;;16-,17?;;/m...0../s1
InChIKeyAIXPINQLFZVXMM-JSLWTDOJSA-N
XLogP22.33
TPSA467.56 Ų
H-Bond Donors12
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms155
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002127.20
LogP ≤ 522.33
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1020

Analyze 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide?
The IUPAC name of 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide (CID 157129733) is 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide.
What is the SMILES notation for 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide?
The canonical SMILES for 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide is CC(C)Oc1ccc(C(=O)Nc2cc(-c3ccncc3)c[nH]c2=O)cc1.O=C(CCc1ccccc1)Nc1cc(-c2ccncc2)c[nH]c1=O.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)C1C[C@H]1c1ccccc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(Br)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(C2CCCCC2)cc1.O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide?
The InChIKey is AIXPINQLFZVXMM-JSLWTDOJSA-N. The full InChI is InChI=1S/C23H17N3O3.C23H23N3O2.C20H19N3O3.C20H17N3O2.C19H17N3O2.C17H12BrN3O2/c27-22(17-6-8-20(9-7-17)29-19-4-2-1-3-5-19)26-21-14-18(15-25-23(21)28)16-10-12-24-13-11-16;27-22(19-8-6-17(7-9-19)16-4-2-1-3-5-16)26-21-14-20(15-25-23(21)28)18-10-12-24-13-11-18;1-13(2)26-17-5-3-15(4-6-17)19(24)23-18-11-16(12-22-20(18)25)14-7-9-21-10-8-14;24-19(17-11-16(17)14-4-2-1-3-5-14)23-18-10-15(12-22-20(18)25)13-6-8-21-9-7-13;23-18(7-6-14-4-2-1-3-5-14)22-17-12-16(13-21-19(17)24)15-8-10-20-11-9-15;18-14-3-1-12(2-4-14)16(22)21-15-9-13(10-20-17(15)23)11-5-7-19-8-6-11/h1-15H,(H,25,28)(H,26,27);6-16H,1-5H2,(H,25,28)(H,26,27);3-13H,1-2H3,(H,22,25)(H,23,24);1-10,12,16-17H,11H2,(H,22,25)(H,23,24);1-5,8-13H,6-7H2,(H,21,24)(H,22,23);1-10H,(H,20,23)(H,21,22)/t;;;16-,17?;;/m...0../s1.
What are the key properties of 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide?
4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide has a molecular weight of 2127.20 g/mol, XLogP of 22.33, 26 rotatable bonds, 12 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;4-cyclohexyl-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)benzamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-phenoxybenzamide;(2R)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-phenylcyclopropane-1-carboxamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenylpropanamide;N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-4-propan-2-yloxybenzamide is sourced from PubChem (CID 157129733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).