1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide

C11H15N3O3 — CID 47394446

IUPAC1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide
SMILESCNC(=O)c1ccc(=O)n(CC(=O)N(C)C)c1
InChIInChI=1S/C11H15N3O3/c1-12-11(17)8-4-5-9(15)14(6-8)7-10(16)13(2)3/h4-6H,7H2,1-3H3,(H,12,17)
InChIKeyCMEUITPWWYXKEY-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.70
Rot. Bonds3

About 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide

1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide (PubChem CID 47394446) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide
PubChem CID47394446
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide
SMILESCNC(=O)c1ccc(=O)n(CC(=O)N(C)C)c1
InChIInChI=1S/C11H15N3O3/c1-12-11(17)8-4-5-9(15)14(6-8)7-10(16)13(2)3/h4-6H,7H2,1-3H3,(H,12,17)
InChIKeyCMEUITPWWYXKEY-UHFFFAOYSA-N
XLogP-0.70
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide (CID 47394446) is 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide is CNC(=O)c1ccc(=O)n(CC(=O)N(C)C)c1.
What is the InChIKey of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is CMEUITPWWYXKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-12-11(17)8-4-5-9(15)14(6-8)7-10(16)13(2)3/h4-6H,7H2,1-3H3,(H,12,17).
What are the key properties of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide?
1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 47394446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).