5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide

C24H26N2O4 — CID 42442156

IUPAC5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(COc2cn(C)c(C(=O)Nc3ccccc3C(C)C)cc2=O)c1
InChIInChI=1S/C24H26N2O4/c1-16(2)19-10-5-6-11-20(19)25-24(28)21-13-22(27)23(14-26(21)3)30-15-17-8-7-9-18(12-17)29-4/h5-14,16H,15H2,1-4H3,(H,25,28)
InChIKeyRPONKXBBOVMURC-UHFFFAOYSA-N
MW406.48 g/mol
LogP4.35
Rot. Bonds7

About 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide

5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide (PubChem CID 42442156) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
PubChem CID42442156
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC Name5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(COc2cn(C)c(C(=O)Nc3ccccc3C(C)C)cc2=O)c1
InChIInChI=1S/C24H26N2O4/c1-16(2)19-10-5-6-11-20(19)25-24(28)21-13-22(27)23(14-26(21)3)30-15-17-8-7-9-18(12-17)29-4/h5-14,16H,15H2,1-4H3,(H,25,28)
InChIKeyRPONKXBBOVMURC-UHFFFAOYSA-N
XLogP4.35
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.48
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 51054762
1-methoxy-3-[(2-propan-2-ylphenoxy)methyl]benzene
CID 60627362
N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
CID 84590450
N-(4-tert-butyl-1,3-thiazol-2-yl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 51054785
1-(3-methoxyphenyl)-3-(2-propan-2-ylphenyl)urea
CID 99129467
3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
CID 46756320
2-chloro-2-fluoro-N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
CID 166427866
N-(3,4-dimethoxyphenyl)-5-[(3-methoxyphenyl)methoxy]-4-oxopyran-2-carboxamide
CID 42317193
5-[(3-methoxyphenyl)methoxy]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxopyran-2-carboxamide
CID 42317250
3-ethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 799138
4-acetyl-N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-1-methylpyrrole-2-carboxamide
CID 51257940
N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide
CID 166328881

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide (CID 42442156) is 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide is COc1cccc(COc2cn(C)c(C(=O)Nc3ccccc3C(C)C)cc2=O)c1.
What is the InChIKey of 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide?
The InChIKey is RPONKXBBOVMURC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c1-16(2)19-10-5-6-11-20(19)25-24(28)21-13-22(27)23(14-26(21)3)30-15-17-8-7-9-18(12-17)29-4/h5-14,16H,15H2,1-4H3,(H,25,28).
What are the key properties of 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide?
5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide has a molecular weight of 406.48 g/mol, XLogP of 4.35, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methoxyphenyl)methoxy]-1-methyl-4-oxo-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 42442156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).