2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide

C24H21N3O3 — CID 23040873

IUPAC2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1c(-c2ccco2)n(Cc2ccncc2)c(C)cc1=O
InChIInChI=1S/C24H21N3O3/c1-16-6-3-4-7-19(16)26-24(29)22-20(28)14-17(2)27(15-18-9-11-25-12-10-18)23(22)21-8-5-13-30-21/h3-14H,15H2,1-2H3,(H,26,29)
InChIKeyDKJGADQVGLWJRR-UHFFFAOYSA-N
MW399.45 g/mol
LogP4.42
Rot. Bonds5

About 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide

2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 23040873) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
PubChem CID23040873
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC Name2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1c(-c2ccco2)n(Cc2ccncc2)c(C)cc1=O
InChIInChI=1S/C24H21N3O3/c1-16-6-3-4-7-19(16)26-24(29)22-20(28)14-17(2)27(15-18-9-11-25-12-10-18)23(22)21-8-5-13-30-21/h3-14H,15H2,1-2H3,(H,26,29)
InChIKeyDKJGADQVGLWJRR-UHFFFAOYSA-N
XLogP4.42
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040772
1-benzyl-2-(furan-2-yl)-6-methyl-4-oxo-N-phenylpyridine-3-carboxamide
CID 14252505
1-benzyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-phenylpyridine-3-carboxamide
CID 14252502
1-[(4-chlorophenyl)methyl]-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
CID 23040883
6-methyl-4-oxo-N-phenyl-2-pyridin-4-yl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040319
1-benzyl-N-(2-chlorophenyl)-6-methyl-2-(2-methylphenyl)-4-oxopyridine-3-carboxamide
CID 23040717
6-methyl-1-[(4-methylphenyl)methyl]-4-oxo-N-phenyl-2-pyridin-4-ylpyridine-3-carboxamide
CID 23040715
N,2-bis(2-chlorophenyl)-1-(furan-2-ylmethyl)-6-methyl-4-oxopyridine-3-carboxamide
CID 23040529
6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-yl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 23040556
1-benzyl-6-methyl-N-(2-methylphenyl)-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040088
1-butyl-6-methyl-N-(2-methylphenyl)-4-oxo-2-pyridin-3-ylpyridine-3-carboxamide
CID 23040109
2-(2-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methyl-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 23040706

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide (CID 23040873) is 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide is Cc1ccccc1NC(=O)c1c(-c2ccco2)n(Cc2ccncc2)c(C)cc1=O.
What is the InChIKey of 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is DKJGADQVGLWJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-16-6-3-4-7-19(16)26-24(29)22-20(28)14-17(2)27(15-18-9-11-25-12-10-18)23(22)21-8-5-13-30-21/h3-14H,15H2,1-2H3,(H,26,29).
What are the key properties of 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 399.45 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 23040873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).