3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide

C20H20N2O2 — CID 137478241

IUPAC3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide
SMILESCC(C)C(C(N)=O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O
InChIInChI=1S/C20H20N2O2/c1-12(2)18(19(21)23)16-9-10-17(22-20(16)24)15-8-7-13-5-3-4-6-14(13)11-15/h3-12,18H,1-2H3,(H2,21,23)(H,22,24)
InChIKeyZTKJFFAIVHAPKX-UHFFFAOYSA-N
MW320.39 g/mol
LogP3.42
Rot. Bonds4

About 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide

3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide (PubChem CID 137478241) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide.

Molecular Properties

Compound Name3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide
PubChem CID137478241
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide
SMILESCC(C)C(C(N)=O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O
InChIInChI=1S/C20H20N2O2/c1-12(2)18(19(21)23)16-9-10-17(22-20(16)24)15-8-7-13-5-3-4-6-14(13)11-15/h3-12,18H,1-2H3,(H2,21,23)(H,22,24)
InChIKeyZTKJFFAIVHAPKX-UHFFFAOYSA-N
XLogP3.42
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide?
The IUPAC name of 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide (CID 137478241) is 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide.
What is the SMILES notation for 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide?
The canonical SMILES for 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide is CC(C)C(C(N)=O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O.
What is the InChIKey of 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide?
The InChIKey is ZTKJFFAIVHAPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-12(2)18(19(21)23)16-9-10-17(22-20(16)24)15-8-7-13-5-3-4-6-14(13)11-15/h3-12,18H,1-2H3,(H2,21,23)(H,22,24).
What are the key properties of 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide?
3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide has a molecular weight of 320.39 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(6-naphthalen-2-yl-2-oxo-1H-pyridin-3-yl)butanamide is sourced from PubChem (CID 137478241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).