5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide

C26H24N2O6 — CID 18387225

IUPAC5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide
SMILESCOc1cc(CNC(=O)c2oc(=O)c3ncccc3c2-c2ccc(C)cc2)cc(OC)c1OC
InChIInChI=1S/C26H24N2O6/c1-15-7-9-17(10-8-15)21-18-6-5-11-27-22(18)26(30)34-24(21)25(29)28-14-16-12-19(31-2)23(33-4)20(13-16)32-3/h5-13H,14H2,1-4H3,(H,28,29)
InChIKeyMKAKYDRLETXACD-UHFFFAOYSA-N
MW460.49 g/mol
LogP4.12
Rot. Bonds7

About 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide

5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide (PubChem CID 18387225) has the molecular formula C26H24N2O6 and a molecular weight of 460.49 g/mol. Its IUPAC name is 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide
PubChem CID18387225
Molecular FormulaC26H24N2O6
Molecular Weight460.49 g/mol
Exact Mass460.16
IUPAC Name5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide
SMILESCOc1cc(CNC(=O)c2oc(=O)c3ncccc3c2-c2ccc(C)cc2)cc(OC)c1OC
InChIInChI=1S/C26H24N2O6/c1-15-7-9-17(10-8-15)21-18-6-5-11-27-22(18)26(30)34-24(21)25(29)28-14-16-12-19(31-2)23(33-4)20(13-16)32-3/h5-13H,14H2,1-4H3,(H,28,29)
InChIKeyMKAKYDRLETXACD-UHFFFAOYSA-N
XLogP4.12
TPSA99.89 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.49
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide
CID 139935058
8-oxo-5-(3,4,5-trimethoxyphenyl)pyrano[3,4-b]pyridine-6-carboxylic acid
CID 11152505
7-[(3S)-4-hydroxy-3-methylbutyl]-5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]-1,7-naphthyridine-6-carboxamide
CID 18661039
N-[(3,5-dichlorophenyl)methyl]-5-(4-methylphenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxamide
CID 175235115
4-pyridin-3-yl-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide
CID 59672655
N-[(3,4,5-trimethoxyphenyl)methyl]-1-benzofuran-2-carboxamide
CID 9483304
2-methyl-1-[(4-methylphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]guanidine
CID 111243917
2-pyrrolidin-1-yl-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide
CID 17482313
2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 743463
2-methyl-1-[(4-methylphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]guanidine;hydroiodide
CID 111243916
3-(4-methylphenyl)-N-[(3,4,5-trimethoxyphenyl)methyl]propanamide
CID 16574584
2-amino-3,4,5-trimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 110181256

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide?
The IUPAC name of 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide (CID 18387225) is 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide.
What is the SMILES notation for 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide?
The canonical SMILES for 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide is COc1cc(CNC(=O)c2oc(=O)c3ncccc3c2-c2ccc(C)cc2)cc(OC)c1OC.
What is the InChIKey of 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide?
The InChIKey is MKAKYDRLETXACD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O6/c1-15-7-9-17(10-8-15)21-18-6-5-11-27-22(18)26(30)34-24(21)25(29)28-14-16-12-19(31-2)23(33-4)20(13-16)32-3/h5-13H,14H2,1-4H3,(H,28,29).
What are the key properties of 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide?
5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide has a molecular weight of 460.49 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide is sourced from PubChem (CID 18387225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).