N-(2-methyl-4-oxopentan-2-yl)acetamide

C8H15NO2 — CID 11062643

IUPACN-(2-methyl-4-oxopentan-2-yl)acetamide
SMILESCC(=O)CC(C)(C)NC(C)=O
InChIInChI=1S/C8H15NO2/c1-6(10)5-8(3,4)9-7(2)11/h5H2,1-4H3,(H,9,11)
InChIKeyADZBLCRDWZGXAI-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.88
Rot. Bonds3

About N-(2-methyl-4-oxopentan-2-yl)acetamide

N-(2-methyl-4-oxopentan-2-yl)acetamide (PubChem CID 11062643) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-(2-methyl-4-oxopentan-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-4-oxopentan-2-yl)acetamide
PubChem CID11062643
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-(2-methyl-4-oxopentan-2-yl)acetamide
SMILESCC(=O)CC(C)(C)NC(C)=O
InChIInChI=1S/C8H15NO2/c1-6(10)5-8(3,4)9-7(2)11/h5H2,1-4H3,(H,9,11)
InChIKeyADZBLCRDWZGXAI-UHFFFAOYSA-N
XLogP0.88
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-methyl-4-oxopentan-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-oxopentan-2-yl)acetamide?
The IUPAC name of N-(2-methyl-4-oxopentan-2-yl)acetamide (CID 11062643) is N-(2-methyl-4-oxopentan-2-yl)acetamide.
What is the SMILES notation for N-(2-methyl-4-oxopentan-2-yl)acetamide?
The canonical SMILES for N-(2-methyl-4-oxopentan-2-yl)acetamide is CC(=O)CC(C)(C)NC(C)=O.
What is the InChIKey of N-(2-methyl-4-oxopentan-2-yl)acetamide?
The InChIKey is ADZBLCRDWZGXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6(10)5-8(3,4)9-7(2)11/h5H2,1-4H3,(H,9,11).
What are the key properties of N-(2-methyl-4-oxopentan-2-yl)acetamide?
N-(2-methyl-4-oxopentan-2-yl)acetamide has a molecular weight of 157.21 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-oxopentan-2-yl)acetamide is sourced from PubChem (CID 11062643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).