1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide

C7H10N2O2 — CID 175819139

IUPAC1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide
SMILESCN1C=CC(=O)C(C(N)=O)C1
InChIInChI=1S/C7H10N2O2/c1-9-3-2-6(10)5(4-9)7(8)11/h2-3,5H,4H2,1H3,(H2,8,11)
InChIKeyHXTMATFYEBDSKJ-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.88
Rot. Bonds1

About 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide

1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide (PubChem CID 175819139) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide
PubChem CID175819139
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide
SMILESCN1C=CC(=O)C(C(N)=O)C1
InChIInChI=1S/C7H10N2O2/c1-9-3-2-6(10)5(4-9)7(8)11/h2-3,5H,4H2,1H3,(H2,8,11)
InChIKeyHXTMATFYEBDSKJ-UHFFFAOYSA-N
XLogP-0.88
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide?
The IUPAC name of 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide (CID 175819139) is 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide?
The canonical SMILES for 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide is CN1C=CC(=O)C(C(N)=O)C1.
What is the InChIKey of 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide?
The InChIKey is HXTMATFYEBDSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-9-3-2-6(10)5(4-9)7(8)11/h2-3,5H,4H2,1H3,(H2,8,11).
What are the key properties of 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide?
1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide has a molecular weight of 154.17 g/mol, XLogP of -0.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-oxo-2,3-dihydropyridine-3-carboxamide is sourced from PubChem (CID 175819139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).