2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide

C17H25N3O3 — CID 87050345

IUPAC2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide
SMILESCC(=O)Nc1ccc(C)n(CC(=O)NC2CCCCCC2)c1=O
InChIInChI=1S/C17H25N3O3/c1-12-9-10-15(18-13(2)21)17(23)20(12)11-16(22)19-14-7-5-3-4-6-8-14/h9-10,14H,3-8,11H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyMJGCWMLGLQAORH-UHFFFAOYSA-N
MW319.40 g/mol
LogP1.95
Rot. Bonds4

About 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide

2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide (PubChem CID 87050345) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide.

Molecular Properties

Compound Name2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide
PubChem CID87050345
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide
SMILESCC(=O)Nc1ccc(C)n(CC(=O)NC2CCCCCC2)c1=O
InChIInChI=1S/C17H25N3O3/c1-12-9-10-15(18-13(2)21)17(23)20(12)11-16(22)19-14-7-5-3-4-6-8-14/h9-10,14H,3-8,11H2,1-2H3,(H,18,21)(H,19,22)
InChIKeyMJGCWMLGLQAORH-UHFFFAOYSA-N
XLogP1.95
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(cyclopropylamino)-2-oxoethyl]-6-methyl-2-oxopyridine-3-carboxylic acid
CID 62874027
6-methyl-1-[2-(oxan-4-ylamino)-2-oxoethyl]-2-oxopyridine-3-carboxylic acid
CID 63098014
N-cycloheptyl-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
CID 110680359
2-(4-acetamidoindol-1-yl)-N-cyclohexylacetamide
CID 71829005
2-(3-acetamido-2-methylanilino)-N-cyclooctylacetamide
CID 34067869
N-cyclooctyl-2-(4-methyl-1-oxophthalazin-2-yl)acetamide
CID 51179223
N-cyclohexyl-2-(2,4-dioxo-1H-pyrimidin-3-yl)acetamide
CID 103603459
3-[2-(cyclopentylamino)-2-oxoethyl]-2-methylimidazole-4-carboxylic acid
CID 65172485
N-cyclooctyl-2-(3-ethyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 22110617
2-(2-acetamidophenoxy)-N-cyclooctylacetamide
CID 17457791
2-(4-chloro-2-methyl-6-oxopyrimidin-1-yl)-N-cycloheptylacetamide
CID 114581619
1-cyclopentyl-3-[2-(2,5-dimethylpyrrol-1-yl)ethyl]urea
CID 110747697

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide?
The IUPAC name of 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide (CID 87050345) is 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide.
What is the SMILES notation for 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide?
The canonical SMILES for 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide is CC(=O)Nc1ccc(C)n(CC(=O)NC2CCCCCC2)c1=O.
What is the InChIKey of 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide?
The InChIKey is MJGCWMLGLQAORH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-12-9-10-15(18-13(2)21)17(23)20(12)11-16(22)19-14-7-5-3-4-6-8-14/h9-10,14H,3-8,11H2,1-2H3,(H,18,21)(H,19,22).
What are the key properties of 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide?
2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide has a molecular weight of 319.40 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamido-6-methyl-2-oxo-1-pyridinyl)-N-cycloheptylacetamide is sourced from PubChem (CID 87050345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).