N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

C16H20N2O3S — CID 50959243

IUPACN-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCOC(CNC(=O)c1c(C)cc(C)n(C)c1=O)c1cccs1
InChIInChI=1S/C16H20N2O3S/c1-10-8-11(2)18(3)16(20)14(10)15(19)17-9-12(21-4)13-6-5-7-22-13/h5-8,12H,9H2,1-4H3,(H,17,19)
InChIKeyXYIHSQARVCVJQD-UHFFFAOYSA-N
MW320.41 g/mol
LogP2.18
Rot. Bonds5

About N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (PubChem CID 50959243) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
PubChem CID50959243
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC NameN-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCOC(CNC(=O)c1c(C)cc(C)n(C)c1=O)c1cccs1
InChIInChI=1S/C16H20N2O3S/c1-10-8-11(2)18(3)16(20)14(10)15(19)17-9-12(21-4)13-6-5-7-22-13/h5-8,12H,9H2,1-4H3,(H,17,19)
InChIKeyXYIHSQARVCVJQD-UHFFFAOYSA-N
XLogP2.18
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
CID 95120648
N-[(2R)-2-methoxy-2-thiophen-2-ylethyl]-4-oxo-3H-quinazoline-2-carboxamide
CID 136818121
N-[(2S)-2-methoxy-2-thiophen-2-ylethyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
CID 95134823
N-[(2R)-2-methoxy-2-thiophen-2-ylethyl]-3-(1-methylpiperidin-4-yl)propanamide
CID 126436086
1-(2-imidazol-1-ylethyl)-3-[(2S)-2-methoxy-2-thiophen-2-ylethyl]-1-methylurea
CID 126433948
N-(2-hydroxy-2-thiophen-2-ylethyl)-2,6-dimethoxybenzamide
CID 90500029
1,4,6-trimethyl-2-oxo-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 110860792
N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2,6-dimethoxybenzamide
CID 30834274
3-[(2S)-2-methoxy-2-thiophen-2-ylethyl]-1-methyl-1-[(4-propan-2-yl-1,2,4-triazol-3-yl)methyl]urea
CID 126423877
N,N,1,4,6-pentamethyl-2-oxopyridine-3-carboxamide
CID 23741260
2,6-dimethoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 16831434
N-(2-cyanophenyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
CID 110864709

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (CID 50959243) is N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is COC(CNC(=O)c1c(C)cc(C)n(C)c1=O)c1cccs1.
What is the InChIKey of N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The InChIKey is XYIHSQARVCVJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c1-10-8-11(2)18(3)16(20)14(10)15(19)17-9-12(21-4)13-6-5-7-22-13/h5-8,12H,9H2,1-4H3,(H,17,19).
What are the key properties of N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 320.41 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 50959243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).