N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide

C16H18N2O3 — CID 42440772

IUPACN-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
SMILESCCNC(=O)c1cc(=O)c(OCc2ccccc2)cn1C
InChIInChI=1S/C16H18N2O3/c1-3-17-16(20)13-9-14(19)15(10-18(13)2)21-11-12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3,(H,17,20)
InChIKeySBEJAPBJGIVMMC-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.71
Rot. Bonds5

About N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide

N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide (PubChem CID 42440772) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
PubChem CID42440772
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide
SMILESCCNC(=O)c1cc(=O)c(OCc2ccccc2)cn1C
InChIInChI=1S/C16H18N2O3/c1-3-17-16(20)13-9-14(19)15(10-18(13)2)21-11-12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3,(H,17,20)
InChIKeySBEJAPBJGIVMMC-UHFFFAOYSA-N
XLogP1.71
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(Benzyloxy)-2-methylpyridin-4(1H)-one
CID 2726416
1-[4-(Benzylamino)butyl]-2-methyl-3-phenylmethoxypyridin-4-one
CID 162666832
N-(2-ethoxy-2-phenylethyl)-1,5-dimethyl-N-[2-(methylamino)-2-oxoethyl]-6-oxopyridine-3-carboxamide
CID 164609717
2-(Aminomethyl)-3-(benzyloxy)-1,6-dimethyl-1,4-dihydropyridin-4-one
CID 11139785
1-Ethyl-2-methyl-3-phenylmethoxypyridin-4-one
CID 14956282
1-(2'-Aminoethyl)-3-benzyloxy-2-methyl-4-pyridinone
CID 44328255
2-Methyl-3-phenylmethoxy-1-propan-2-ylpyridin-4-one
CID 14956286
2-(5-((2-fluorobenzyl)oxy)-2-methyl-4-oxopyridin-1(4H)-yl)-N-((tetrahydrofuran-2-yl)methyl)acetamide
CID 16852776
2-(5-((2-fluorobenzyl)oxy)-2-methyl-4-oxopyridin-1(4H)-yl)-N-isopropylacetamide
CID 16852791
N-cyclopentyl-2-(5-((4-fluorobenzyl)oxy)-2-methyl-4-oxopyridin-1(4H)-yl)acetamide
CID 16852853
2-(5-((4-fluorobenzyl)oxy)-2-methyl-4-oxopyridin-1(4H)-yl)-N-(2-methoxyethyl)acetamide
CID 16852879
2-(5-(benzyloxy)-2-(hydroxymethyl)-4-oxopyridin-1(4H)-yl)-N-(2-methoxyethyl)acetamide
CID 16853659

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
The IUPAC name of N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide (CID 42440772) is N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
The canonical SMILES for N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide is CCNC(=O)c1cc(=O)c(OCc2ccccc2)cn1C.
What is the InChIKey of N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
The InChIKey is SBEJAPBJGIVMMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-3-17-16(20)13-9-14(19)15(10-18(13)2)21-11-12-7-5-4-6-8-12/h4-10H,3,11H2,1-2H3,(H,17,20).
What are the key properties of N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide?
N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methyl-4-oxo-5-phenylmethoxypyridine-2-carboxamide is sourced from PubChem (CID 42440772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).