N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid

C94H91N7O14 — CID 159648699

IUPACN-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid
SMILESCCNC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(C)c1=O.CCNC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(O)c1=O.CCOC(=O)c1c[nH]cc(C)c1=O.CCOC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(C)c1=O.Cc1cn(Cc2ccccc2-c2ccccc2)cc(C(=O)O)c1=O
InChIInChI=1S/C22H22N2O2.C22H21NO3.C21H20N2O3.C20H17NO3.C9H11NO3/c1-3-23-22(26)20-15-24(13-16(2)21(20)25)14-18-11-7-8-12-19(18)17-9-5-4-6-10-17;1-3-26-22(25)20-15-23(13-16(2)21(20)24)14-18-11-7-8-12-19(18)17-9-5-4-6-10-17;1-2-22-21(26)18-13-23(14-19(24)20(18)25)12-16-10-6-7-11-17(16)15-8-4-3-5-9-15;1-14-11-21(13-18(19(14)22)20(23)24)12-16-9-5-6-10-17(16)15-7-3-2-4-8-15;1-3-13-9(12)7-5-10-4-6(2)8(7)11/h4-13,15H,3,14H2,1-2H3,(H,23,26);4-13,15H,3,14H2,1-2H3;3-11,13-14,24H,2,12H2,1H3,(H,22,26);2-11,13H,12H2,1H3,(H,23,24);4-5H,3H2,1-2H3,(H,10,11)
InChIKeyMRHBZBPJUZPYHC-UHFFFAOYSA-N
MW1542.80 g/mol
LogP15.12
Rot. Bonds21

About N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid

N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid (PubChem CID 159648699) has the molecular formula C94H91N7O14 and a molecular weight of 1542.80 g/mol. Its IUPAC name is N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid.

Molecular Properties

Compound NameN-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid
PubChem CID159648699
Molecular FormulaC94H91N7O14
Molecular Weight1542.80 g/mol
Exact Mass1541.66
IUPAC NameN-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid
SMILESCCNC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(C)c1=O.CCNC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(O)c1=O.CCOC(=O)c1c[nH]cc(C)c1=O.CCOC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(C)c1=O.Cc1cn(Cc2ccccc2-c2ccccc2)cc(C(=O)O)c1=O
InChIInChI=1S/C22H22N2O2.C22H21NO3.C21H20N2O3.C20H17NO3.C9H11NO3/c1-3-23-22(26)20-15-24(13-16(2)21(20)25)14-18-11-7-8-12-19(18)17-9-5-4-6-10-17;1-3-26-22(25)20-15-23(13-16(2)21(20)24)14-18-11-7-8-12-19(18)17-9-5-4-6-10-17;1-2-22-21(26)18-13-23(14-19(24)20(18)25)12-16-10-6-7-11-17(16)15-8-4-3-5-9-15;1-14-11-21(13-18(19(14)22)20(23)24)12-16-9-5-6-10-17(16)15-7-3-2-4-8-15;1-3-13-9(12)7-5-10-4-6(2)8(7)11/h4-13,15H,3,14H2,1-2H3,(H,23,26);4-13,15H,3,14H2,1-2H3;3-11,13-14,24H,2,12H2,1H3,(H,22,26);2-11,13H,12H2,1H3,(H,23,24);4-5H,3H2,1-2H3,(H,10,11)
InChIKeyMRHBZBPJUZPYHC-UHFFFAOYSA-N
XLogP15.12
TPSA289.19 Ų
H-Bond Donors5
H-Bond Acceptors17
Rotatable Bonds21
Heavy Atoms115
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001542.80
LogP ≤ 515.12
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1017

Analyze N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid?
The IUPAC name of N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid (CID 159648699) is N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid.
What is the SMILES notation for N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid?
The canonical SMILES for N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid is CCNC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(C)c1=O.CCNC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(O)c1=O.CCOC(=O)c1c[nH]cc(C)c1=O.CCOC(=O)c1cn(Cc2ccccc2-c2ccccc2)cc(C)c1=O.Cc1cn(Cc2ccccc2-c2ccccc2)cc(C(=O)O)c1=O.
What is the InChIKey of N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid?
The InChIKey is MRHBZBPJUZPYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O2.C22H21NO3.C21H20N2O3.C20H17NO3.C9H11NO3/c1-3-23-22(26)20-15-24(13-16(2)21(20)25)14-18-11-7-8-12-19(18)17-9-5-4-6-10-17;1-3-26-22(25)20-15-23(13-16(2)21(20)24)14-18-11-7-8-12-19(18)17-9-5-4-6-10-17;1-2-22-21(26)18-13-23(14-19(24)20(18)25)12-16-10-6-7-11-17(16)15-8-4-3-5-9-15;1-14-11-21(13-18(19(14)22)20(23)24)12-16-9-5-6-10-17(16)15-7-3-2-4-8-15;1-3-13-9(12)7-5-10-4-6(2)8(7)11/h4-13,15H,3,14H2,1-2H3,(H,23,26);4-13,15H,3,14H2,1-2H3;3-11,13-14,24H,2,12H2,1H3,(H,22,26);2-11,13H,12H2,1H3,(H,23,24);4-5H,3H2,1-2H3,(H,10,11).
What are the key properties of N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid?
N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid has a molecular weight of 1542.80 g/mol, XLogP of 15.12, 21 rotatable bonds, 5 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-hydroxy-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;N-ethyl-5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxamide;ethyl 5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylate;ethyl 5-methyl-4-oxo-1H-pyridine-3-carboxylate;5-methyl-4-oxo-1-[(2-phenylphenyl)methyl]pyridine-3-carboxylic acid is sourced from PubChem (CID 159648699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).