1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide

C17H19N3O4 — CID 102398877

IUPAC1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide
SMILESCCCN(C(=O)c1cccn(C)c1=O)C(=O)c1cccn(C)c1=O
InChIInChI=1S/C17H19N3O4/c1-4-9-20(16(23)12-7-5-10-18(2)14(12)21)17(24)13-8-6-11-19(3)15(13)22/h5-8,10-11H,4,9H2,1-3H3
InChIKeyDOTUIMODPYCHSE-UHFFFAOYSA-N
MW329.36 g/mol
LogP0.78
Rot. Bonds4

About 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide

1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide (PubChem CID 102398877) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide
PubChem CID102398877
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC Name1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide
SMILESCCCN(C(=O)c1cccn(C)c1=O)C(=O)c1cccn(C)c1=O
InChIInChI=1S/C17H19N3O4/c1-4-9-20(16(23)12-7-5-10-18(2)14(12)21)17(24)13-8-6-11-19(3)15(13)22/h5-8,10-11H,4,9H2,1-3H3
InChIKeyDOTUIMODPYCHSE-UHFFFAOYSA-N
XLogP0.78
TPSA81.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide?
The IUPAC name of 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide (CID 102398877) is 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide?
The canonical SMILES for 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide is CCCN(C(=O)c1cccn(C)c1=O)C(=O)c1cccn(C)c1=O.
What is the InChIKey of 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide?
The InChIKey is DOTUIMODPYCHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-4-9-20(16(23)12-7-5-10-18(2)14(12)21)17(24)13-8-6-11-19(3)15(13)22/h5-8,10-11H,4,9H2,1-3H3.
What are the key properties of 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide?
1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 0.78, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1-methyl-2-oxopyridine-3-carbonyl)-2-oxo-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 102398877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).