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

C26H25N3O3 — CID 118756559

IUPACN-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCc2ccco2)c(CCc2ccccc2)n1Cc1ccncc1
InChIInChI=1S/C26H25N3O3/c1-19-16-24(30)25(26(31)28-17-22-8-5-15-32-22)23(10-9-20-6-3-2-4-7-20)29(19)18-21-11-13-27-14-12-21/h2-8,11-16H,9-10,17-18H2,1H3,(H,28,31)
InChIKeyAMCIISZMFAPGMO-UHFFFAOYSA-N
MW427.50 g/mol
LogP3.91
Rot. Bonds8

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

N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 118756559) has the molecular formula C26H25N3O3 and a molecular weight of 427.50 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
PubChem CID118756559
Molecular FormulaC26H25N3O3
Molecular Weight427.50 g/mol
Exact Mass427.19
IUPAC NameN-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)NCc2ccco2)c(CCc2ccccc2)n1Cc1ccncc1
InChIInChI=1S/C26H25N3O3/c1-19-16-24(30)25(26(31)28-17-22-8-5-15-32-22)23(10-9-20-6-3-2-4-7-20)29(19)18-21-11-13-27-14-12-21/h2-8,11-16H,9-10,17-18H2,1H3,(H,28,31)
InChIKeyAMCIISZMFAPGMO-UHFFFAOYSA-N
XLogP3.91
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.50
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide with MolForge

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Related Compounds

N-ethyl-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 26337612
N-(2-methoxyethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42484940
6-methyl-4-oxo-2-(2-phenylethyl)-N-propan-2-yl-1-(pyridin-2-ylmethyl)pyridine-3-carboxamide
CID 42472455
2-(furan-2-yl)-6-methyl-N-(2-methylphenyl)-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040873
2-(cyclopentylmethyl)-6-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-4-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 26353788
6-methyl-4-oxo-N-phenyl-2-pyridin-4-yl-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040319
N-(3-imidazol-1-ylpropyl)-6-methyl-2-[(2-methylphenyl)methyl]-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 42471928
4-[(4-benzyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-(furan-2-ylmethyl)benzamide
CID 24718336
N-(2,3-dimethylphenyl)-2-(furan-2-yl)-6-methyl-4-oxo-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 23040772
N-(2,3-dimethylphenyl)-1-(furan-2-ylmethyl)-6-methyl-4-oxo-2-propylpyridine-3-carboxamide
CID 23040477
4-benzyl-2-(3-chloro-4-methylphenyl)-N-(furan-2-ylmethyl)-3,5-dioxo-1,2,4-triazine-6-carboxamide
CID 42836364
N-(2-chlorophenyl)-1-(furan-2-ylmethyl)-6-methyl-2-(2-methylpropyl)-4-oxopyridine-3-carboxamide
CID 23040785

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide (CID 118756559) is N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)NCc2ccco2)c(CCc2ccccc2)n1Cc1ccncc1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is AMCIISZMFAPGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O3/c1-19-16-24(30)25(26(31)28-17-22-8-5-15-32-22)23(10-9-20-6-3-2-4-7-20)29(19)18-21-11-13-27-14-12-21/h2-8,11-16H,9-10,17-18H2,1H3,(H,28,31).
What are the key properties of N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 427.50 g/mol, XLogP of 3.91, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-methyl-4-oxo-2-(2-phenylethyl)-1-(pyridin-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 118756559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).