N,2,2-trimethyl-4-oxopentanamide

C8H15NO2 — CID 153336709

IUPACN,2,2-trimethyl-4-oxopentanamide
SMILESCNC(=O)C(C)(C)CC(C)=O
InChIInChI=1S/C8H15NO2/c1-6(10)5-8(2,3)7(11)9-4/h5H2,1-4H3,(H,9,11)
InChIKeyUHLSOAHRACOHSD-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.74
Rot. Bonds3

About N,2,2-trimethyl-4-oxopentanamide

N,2,2-trimethyl-4-oxopentanamide (PubChem CID 153336709) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N,2,2-trimethyl-4-oxopentanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-4-oxopentanamide
PubChem CID153336709
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN,2,2-trimethyl-4-oxopentanamide
SMILESCNC(=O)C(C)(C)CC(C)=O
InChIInChI=1S/C8H15NO2/c1-6(10)5-8(2,3)7(11)9-4/h5H2,1-4H3,(H,9,11)
InChIKeyUHLSOAHRACOHSD-UHFFFAOYSA-N
XLogP0.74
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 ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,2,2-trimethyl-4-oxopentanamide 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,2,2-trimethyl-4-oxopentanamide?
The IUPAC name of N,2,2-trimethyl-4-oxopentanamide (CID 153336709) is N,2,2-trimethyl-4-oxopentanamide.
What is the SMILES notation for N,2,2-trimethyl-4-oxopentanamide?
The canonical SMILES for N,2,2-trimethyl-4-oxopentanamide is CNC(=O)C(C)(C)CC(C)=O.
What is the InChIKey of N,2,2-trimethyl-4-oxopentanamide?
The InChIKey is UHLSOAHRACOHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6(10)5-8(2,3)7(11)9-4/h5H2,1-4H3,(H,9,11).
What are the key properties of N,2,2-trimethyl-4-oxopentanamide?
N,2,2-trimethyl-4-oxopentanamide has a molecular weight of 157.21 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-4-oxopentanamide is sourced from PubChem (CID 153336709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).