N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

C15H18N2O3S — CID 50961651

IUPACN-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESCOCCN(Cc1cccs1)C(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C15H18N2O3S/c1-16-10-12(5-6-14(16)18)15(19)17(7-8-20-2)11-13-4-3-9-21-13/h3-6,9-10H,7-8,11H2,1-2H3
InChIKeyMXOOHPMEACDTKY-UHFFFAOYSA-N
MW306.39 g/mol
LogP1.74
Rot. Bonds6

About N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 50961651) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
PubChem CID50961651
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESCOCCN(Cc1cccs1)C(=O)c1ccc(=O)n(C)c1
InChIInChI=1S/C15H18N2O3S/c1-16-10-12(5-6-14(16)18)15(19)17(7-8-20-2)11-13-4-3-9-21-13/h3-6,9-10H,7-8,11H2,1-2H3
InChIKeyMXOOHPMEACDTKY-UHFFFAOYSA-N
XLogP1.74
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (CID 50961651) is N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is COCCN(Cc1cccs1)C(=O)c1ccc(=O)n(C)c1.
What is the InChIKey of N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is MXOOHPMEACDTKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-16-10-12(5-6-14(16)18)15(19)17(7-8-20-2)11-13-4-3-9-21-13/h3-6,9-10H,7-8,11H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 306.39 g/mol, XLogP of 1.74, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 50961651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).