N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide

C24H20N2O3 — CID 139935058

IUPACN-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide
SMILESCc1cc(C)cc(CNC(=O)c2oc(=O)c3ncccc3c2-c2ccccc2)c1
InChIInChI=1S/C24H20N2O3/c1-15-11-16(2)13-17(12-15)14-26-23(27)22-20(18-7-4-3-5-8-18)19-9-6-10-25-21(19)24(28)29-22/h3-13H,14H2,1-2H3,(H,26,27)
InChIKeyGPNBETHLUZTQBR-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.40
Rot. Bonds4

About N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide

N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide (PubChem CID 139935058) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide
PubChem CID139935058
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC NameN-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide
SMILESCc1cc(C)cc(CNC(=O)c2oc(=O)c3ncccc3c2-c2ccccc2)c1
InChIInChI=1S/C24H20N2O3/c1-15-11-16(2)13-17(12-15)14-26-23(27)22-20(18-7-4-3-5-8-18)19-9-6-10-25-21(19)24(28)29-22/h3-13H,14H2,1-2H3,(H,26,27)
InChIKeyGPNBETHLUZTQBR-UHFFFAOYSA-N
XLogP4.40
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-methylphenyl)-8-oxo-N-[(3,4,5-trimethoxyphenyl)methyl]pyrano[3,4-b]pyridine-6-carboxamide
CID 18387225
8-oxo-5-(3,4,5-trimethoxyphenyl)pyrano[3,4-b]pyridine-6-carboxylic acid
CID 11152505
N-[(3,5-dichlorophenyl)methyl]-5-(4-methylphenyl)-8-oxo-7H-1,7-naphthyridine-6-carboxamide
CID 175235115
N-(furan-2-ylmethyl)-1-oxo-4-phenylisochromene-3-carboxamide
CID 4660207
N-benzyl-7-(5-hydroxypentyl)-8-oxo-5-phenyl-1,7-naphthyridine-6-carboxamide
CID 18387274
N-(2-chloro-4-methylphenyl)-1-oxo-4-phenylisochromene-3-carboxamide
CID 20854042
N-[2-(3,4-diethoxyphenyl)ethyl]-1-oxo-4-phenylisochromene-3-carboxamide
CID 20854050
N-benzyl-5-(3,5-dimethylphenyl)-2-pyridin-3-ylbenzamide
CID 91363537
N-(2,6-diethylphenyl)-1-oxo-4-phenylisochromene-3-carboxamide
CID 4069125
N-[(3-methylphenyl)methyl]-2-phenyl-1,3-oxazole-5-carboxamide
CID 110681408
N-benzyl-2,4,5-triphenylfuran-3-carboxamide
CID 132516883
N-(3,3-diethoxypropyl)-1-oxo-4-phenylisochromene-3-carboxamide
CID 126479967

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide?
The IUPAC name of N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide (CID 139935058) is N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide.
What is the SMILES notation for N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide?
The canonical SMILES for N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide is Cc1cc(C)cc(CNC(=O)c2oc(=O)c3ncccc3c2-c2ccccc2)c1.
What is the InChIKey of N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide?
The InChIKey is GPNBETHLUZTQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-15-11-16(2)13-17(12-15)14-26-23(27)22-20(18-7-4-3-5-8-18)19-9-6-10-25-21(19)24(28)29-22/h3-13H,14H2,1-2H3,(H,26,27).
What are the key properties of N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide?
N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethylphenyl)methyl]-8-oxo-5-phenylpyrano[3,4-b]pyridine-6-carboxamide is sourced from PubChem (CID 139935058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).