5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide

C15H18N2O3S — CID 58808530

IUPAC5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide
SMILESCCc1cc(-c2ccc(C(=O)N(C)OC)s2)c(C)[nH]c1=O
InChIInChI=1S/C15H18N2O3S/c1-5-10-8-11(9(2)16-14(10)18)12-6-7-13(21-12)15(19)17(3)20-4/h6-8H,5H2,1-4H3,(H,16,18)
InChIKeyFANUBISGUUUHJO-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.61
Rot. Bonds4

About 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide

5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide (PubChem CID 58808530) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide
PubChem CID58808530
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC Name5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide
SMILESCCc1cc(-c2ccc(C(=O)N(C)OC)s2)c(C)[nH]c1=O
InChIInChI=1S/C15H18N2O3S/c1-5-10-8-11(9(2)16-14(10)18)12-6-7-13(21-12)15(19)17(3)20-4/h6-8H,5H2,1-4H3,(H,16,18)
InChIKeyFANUBISGUUUHJO-UHFFFAOYSA-N
XLogP2.61
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide?
The IUPAC name of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide (CID 58808530) is 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide.
What is the SMILES notation for 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide?
The canonical SMILES for 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide is CCc1cc(-c2ccc(C(=O)N(C)OC)s2)c(C)[nH]c1=O.
What is the InChIKey of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide?
The InChIKey is FANUBISGUUUHJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-5-10-8-11(9(2)16-14(10)18)12-6-7-13(21-12)15(19)17(3)20-4/h6-8H,5H2,1-4H3,(H,16,18).
What are the key properties of 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide?
5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide has a molecular weight of 306.39 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethyl-2-methyl-6-oxo-1H-pyridin-3-yl)-N-methoxy-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 58808530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).