3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide

C11H16N2O2 — CID 47341997

IUPAC3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide
SMILESCC(C)CC(=O)Nc1ccc(=O)n(C)c1
InChIInChI=1S/C11H16N2O2/c1-8(2)6-10(14)12-9-4-5-11(15)13(3)7-9/h4-5,7-8H,6H2,1-3H3,(H,12,14)
InChIKeyUIWRYZVVDPXSFR-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.37
Rot. Bonds3

About 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide

3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide (PubChem CID 47341997) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide.

Molecular Properties

Compound Name3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide
PubChem CID47341997
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide
SMILESCC(C)CC(=O)Nc1ccc(=O)n(C)c1
InChIInChI=1S/C11H16N2O2/c1-8(2)6-10(14)12-9-4-5-11(15)13(3)7-9/h4-5,7-8H,6H2,1-3H3,(H,12,14)
InChIKeyUIWRYZVVDPXSFR-UHFFFAOYSA-N
XLogP1.37
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide?
The IUPAC name of 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide (CID 47341997) is 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide.
What is the SMILES notation for 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide?
The canonical SMILES for 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide is CC(C)CC(=O)Nc1ccc(=O)n(C)c1.
What is the InChIKey of 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide?
The InChIKey is UIWRYZVVDPXSFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8(2)6-10(14)12-9-4-5-11(15)13(3)7-9/h4-5,7-8H,6H2,1-3H3,(H,12,14).
What are the key properties of 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide?
3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide has a molecular weight of 208.26 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-methyl-6-oxo-3-pyridinyl)butanamide is sourced from PubChem (CID 47341997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).