N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide

C11H16N2O2 — CID 17409434

IUPACN-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESCC(C)CNC(=O)Cn1ccccc1=O
InChIInChI=1S/C11H16N2O2/c1-9(2)7-12-10(14)8-13-6-4-3-5-11(13)15/h3-6,9H,7-8H2,1-2H3,(H,12,14)
InChIKeyOLRAFEDDVGHWHQ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.62
Rot. Bonds4

About N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide

N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 17409434) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID17409434
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC NameN-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide
SMILESCC(C)CNC(=O)Cn1ccccc1=O
InChIInChI=1S/C11H16N2O2/c1-9(2)7-12-10(14)8-13-6-4-3-5-11(13)15/h3-6,9H,7-8H2,1-2H3,(H,12,14)
InChIKeyOLRAFEDDVGHWHQ-UHFFFAOYSA-N
XLogP0.62
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide (CID 17409434) is N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide is CC(C)CNC(=O)Cn1ccccc1=O.
What is the InChIKey of N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is OLRAFEDDVGHWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-9(2)7-12-10(14)8-13-6-4-3-5-11(13)15/h3-6,9H,7-8H2,1-2H3,(H,12,14).
What are the key properties of N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide?
N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 208.26 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 17409434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).