N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide

C24H26N2O3 — CID 42440870

IUPACN-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
SMILESCCCCc1ccc(NC(=O)c2cc(=O)c(OCc3ccccc3)cn2C)cc1
InChIInChI=1S/C24H26N2O3/c1-3-4-8-18-11-13-20(14-12-18)25-24(28)21-15-22(27)23(16-26(21)2)29-17-19-9-6-5-7-10-19/h5-7,9-16H,3-4,8,17H2,1-2H3,(H,25,28)
InChIKeyJUYGXSRREGXYBI-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.56
Rot. Bonds8

About N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide

N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide (PubChem CID 42440870) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
PubChem CID42440870
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
SMILESCCCCc1ccc(NC(=O)c2cc(=O)c(OCc3ccccc3)cn2C)cc1
InChIInChI=1S/C24H26N2O3/c1-3-4-8-18-11-13-20(14-12-18)25-24(28)21-15-22(27)23(16-26(21)2)29-17-19-9-6-5-7-10-19/h5-7,9-16H,3-4,8,17H2,1-2H3,(H,25,28)
InChIKeyJUYGXSRREGXYBI-UHFFFAOYSA-N
XLogP4.56
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 51054762
N-(3-methoxypropyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 52902398
5-[(4-chlorophenyl)methoxy]-1-methyl-4-oxo-N-pyridin-2-ylpyridine-2-carboxamide
CID 52899896
N-(4-tert-butyl-1,3-thiazol-2-yl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 51054785
N-[(1-methyl-4-oxo-5-phenylmethoxy-2-pyridinyl)methyl]hexanamide
CID 167438212
N-[(2-chlorophenyl)methyl]-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
CID 42440806
5-methoxy-1-methyl-4-oxo-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 51054204
1-(4-butylphenyl)-3-phenylmethoxypyridin-4-one
CID 67419599
4-bromo-1-methyl-N-(4-propylphenyl)pyrrole-2-carboxamide
CID 43410940
4-butoxy-N-[4-(3-phenylpropoxy)phenyl]benzamide
CID 17130195
N-(4-butylphenyl)-4-phenylbutanamide
CID 7313944
2-(aminomethyl)-1-methyl-5-phenylmethoxypyridin-4-one
CID 11172595

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
The IUPAC name of N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide (CID 42440870) is N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide.
What is the SMILES notation for N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
The canonical SMILES for N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide is CCCCc1ccc(NC(=O)c2cc(=O)c(OCc3ccccc3)cn2C)cc1.
What is the InChIKey of N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
The InChIKey is JUYGXSRREGXYBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-3-4-8-18-11-13-20(14-12-18)25-24(28)21-15-22(27)23(16-26(21)2)29-17-19-9-6-5-7-10-19/h5-7,9-16H,3-4,8,17H2,1-2H3,(H,25,28).
What are the key properties of N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide has a molecular weight of 390.48 g/mol, XLogP of 4.56, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butylphenyl)-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide is sourced from PubChem (CID 42440870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).