N-(3-methyl-2-oxopentan-3-yl)acetamide

C8H15NO2 — CID 118473299

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

About N-(3-methyl-2-oxopentan-3-yl)acetamide

N-(3-methyl-2-oxopentan-3-yl)acetamide (PubChem CID 118473299) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-(3-methyl-2-oxopentan-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-methyl-2-oxopentan-3-yl)acetamide
PubChem CID118473299
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-(3-methyl-2-oxopentan-3-yl)acetamide
SMILESCCC(C)(NC(C)=O)C(C)=O
InChIInChI=1S/C8H15NO2/c1-5-8(4,6(2)10)9-7(3)11/h5H2,1-4H3,(H,9,11)
InChIKeyHHWGDPXIEWSVOM-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-(3-methyl-2-oxopentan-3-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-(3-methyl-2-oxopentan-3-yl)acetamide?
The IUPAC name of N-(3-methyl-2-oxopentan-3-yl)acetamide (CID 118473299) is N-(3-methyl-2-oxopentan-3-yl)acetamide.
What is the SMILES notation for N-(3-methyl-2-oxopentan-3-yl)acetamide?
The canonical SMILES for N-(3-methyl-2-oxopentan-3-yl)acetamide is CCC(C)(NC(C)=O)C(C)=O.
What is the InChIKey of N-(3-methyl-2-oxopentan-3-yl)acetamide?
The InChIKey is HHWGDPXIEWSVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-5-8(4,6(2)10)9-7(3)11/h5H2,1-4H3,(H,9,11).
What are the key properties of N-(3-methyl-2-oxopentan-3-yl)acetamide?
N-(3-methyl-2-oxopentan-3-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-(3-methyl-2-oxopentan-3-yl)acetamide is sourced from PubChem (CID 118473299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).