4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide

C92H100N16O9 — CID 157440647

IUPAC4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide
SMILESCNc1ccnc(-c2c[nH]c(=O)c(NC(=O)c3ccc(N4CCCCC4)cc3)c2)n1.COc1cccc(-c2c[nH]c(=O)c(NC(=O)c3ccc(C(C)(C)C)cc3)c2)c1.Cc1cc(-c2c[nH]c(=O)c(NC(=O)c3ccc(N4CCCCC4)cc3)c2)nc(C(C)C)n1.Cc1ccncc1-c1c[nH]c(=O)c(NC(=O)c2ccc(C(C)(C)C)cc2)c1
InChIInChI=1S/C25H29N5O2.C23H24N2O3.C22H24N6O2.C22H23N3O2/c1-16(2)23-27-17(3)13-21(28-23)19-14-22(25(32)26-15-19)29-24(31)18-7-9-20(10-8-18)30-11-5-4-6-12-30;1-23(2,3)18-10-8-15(9-11-18)21(26)25-20-13-17(14-24-22(20)27)16-6-5-7-19(12-16)28-4;1-23-19-9-10-24-20(27-19)16-13-18(22(30)25-14-16)26-21(29)15-5-7-17(8-6-15)28-11-3-2-4-12-28;1-14-9-10-23-13-18(14)16-11-19(21(27)24-12-16)25-20(26)15-5-7-17(8-6-15)22(2,3)4/h7-10,13-16H,4-6,11-12H2,1-3H3,(H,26,32)(H,29,31);5-14H,1-4H3,(H,24,27)(H,25,26);5-10,13-14H,2-4,11-12H2,1H3,(H,25,30)(H,26,29)(H,23,24,27);5-13H,1-4H3,(H,24,27)(H,25,26)
InChIKeyBRQBXNYREOBEOW-UHFFFAOYSA-N
MW1573.91 g/mol
LogP16.52
Rot. Bonds17

About 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide

4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide (PubChem CID 157440647) has the molecular formula C92H100N16O9 and a molecular weight of 1573.91 g/mol. Its IUPAC name is 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide.

Molecular Properties

Compound Name4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide
PubChem CID157440647
Molecular FormulaC92H100N16O9
Molecular Weight1573.91 g/mol
Exact Mass1572.79
IUPAC Name4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide
SMILESCNc1ccnc(-c2c[nH]c(=O)c(NC(=O)c3ccc(N4CCCCC4)cc3)c2)n1.COc1cccc(-c2c[nH]c(=O)c(NC(=O)c3ccc(C(C)(C)C)cc3)c2)c1.Cc1cc(-c2c[nH]c(=O)c(NC(=O)c3ccc(N4CCCCC4)cc3)c2)nc(C(C)C)n1.Cc1ccncc1-c1c[nH]c(=O)c(NC(=O)c2ccc(C(C)(C)C)cc2)c1
InChIInChI=1S/C25H29N5O2.C23H24N2O3.C22H24N6O2.C22H23N3O2/c1-16(2)23-27-17(3)13-21(28-23)19-14-22(25(32)26-15-19)29-24(31)18-7-9-20(10-8-18)30-11-5-4-6-12-30;1-23(2,3)18-10-8-15(9-11-18)21(26)25-20-13-17(14-24-22(20)27)16-6-5-7-19(12-16)28-4;1-23-19-9-10-24-20(27-19)16-13-18(22(30)25-14-16)26-21(29)15-5-7-17(8-6-15)28-11-3-2-4-12-28;1-14-9-10-23-13-18(14)16-11-19(21(27)24-12-16)25-20(26)15-5-7-17(8-6-15)22(2,3)4/h7-10,13-16H,4-6,11-12H2,1-3H3,(H,26,32)(H,29,31);5-14H,1-4H3,(H,24,27)(H,25,26);5-10,13-14H,2-4,11-12H2,1H3,(H,25,30)(H,26,29)(H,23,24,27);5-13H,1-4H3,(H,24,27)(H,25,26)
InChIKeyBRQBXNYREOBEOW-UHFFFAOYSA-N
XLogP16.52
TPSA340.03 Ų
H-Bond Donors9
H-Bond Acceptors17
Rotatable Bonds17
Heavy Atoms117
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001573.91
LogP ≤ 516.52
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1017

Analyze 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide?
The IUPAC name of 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide (CID 157440647) is 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide.
What is the SMILES notation for 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide?
The canonical SMILES for 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide is CNc1ccnc(-c2c[nH]c(=O)c(NC(=O)c3ccc(N4CCCCC4)cc3)c2)n1.COc1cccc(-c2c[nH]c(=O)c(NC(=O)c3ccc(C(C)(C)C)cc3)c2)c1.Cc1cc(-c2c[nH]c(=O)c(NC(=O)c3ccc(N4CCCCC4)cc3)c2)nc(C(C)C)n1.Cc1ccncc1-c1c[nH]c(=O)c(NC(=O)c2ccc(C(C)(C)C)cc2)c1.
What is the InChIKey of 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide?
The InChIKey is BRQBXNYREOBEOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N5O2.C23H24N2O3.C22H24N6O2.C22H23N3O2/c1-16(2)23-27-17(3)13-21(28-23)19-14-22(25(32)26-15-19)29-24(31)18-7-9-20(10-8-18)30-11-5-4-6-12-30;1-23(2,3)18-10-8-15(9-11-18)21(26)25-20-13-17(14-24-22(20)27)16-6-5-7-19(12-16)28-4;1-23-19-9-10-24-20(27-19)16-13-18(22(30)25-14-16)26-21(29)15-5-7-17(8-6-15)28-11-3-2-4-12-28;1-14-9-10-23-13-18(14)16-11-19(21(27)24-12-16)25-20(26)15-5-7-17(8-6-15)22(2,3)4/h7-10,13-16H,4-6,11-12H2,1-3H3,(H,26,32)(H,29,31);5-14H,1-4H3,(H,24,27)(H,25,26);5-10,13-14H,2-4,11-12H2,1H3,(H,25,30)(H,26,29)(H,23,24,27);5-13H,1-4H3,(H,24,27)(H,25,26).
What are the key properties of 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide?
4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide has a molecular weight of 1573.91 g/mol, XLogP of 16.52, 17 rotatable bonds, 9 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[5-(3-methoxyphenyl)-2-oxo-1H-pyridin-3-yl]benzamide;4-tert-butyl-N-[5-(4-methyl-3-pyridinyl)-2-oxo-1H-pyridin-3-yl]benzamide;N-[5-[4-(methylamino)pyrimidin-2-yl]-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide;N-[5-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-2-oxo-1H-pyridin-3-yl]-4-piperidin-1-ylbenzamide is sourced from PubChem (CID 157440647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).