3-methyl-N-(4-methyl-3-oxopentyl)butanamide

C11H21NO2 — CID 153392843

IUPAC3-methyl-N-(4-methyl-3-oxopentyl)butanamide
SMILESCC(C)CC(=O)NCCC(=O)C(C)C
InChIInChI=1S/C11H21NO2/c1-8(2)7-11(14)12-6-5-10(13)9(3)4/h8-9H,5-7H2,1-4H3,(H,12,14)
InChIKeyRCXCWFDIBMUVGG-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.76
Rot. Bonds6

About 3-methyl-N-(4-methyl-3-oxopentyl)butanamide

3-methyl-N-(4-methyl-3-oxopentyl)butanamide (PubChem CID 153392843) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-methyl-N-(4-methyl-3-oxopentyl)butanamide.

Molecular Properties

Compound Name3-methyl-N-(4-methyl-3-oxopentyl)butanamide
PubChem CID153392843
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name3-methyl-N-(4-methyl-3-oxopentyl)butanamide
SMILESCC(C)CC(=O)NCCC(=O)C(C)C
InChIInChI=1S/C11H21NO2/c1-8(2)7-11(14)12-6-5-10(13)9(3)4/h8-9H,5-7H2,1-4H3,(H,12,14)
InChIKeyRCXCWFDIBMUVGG-UHFFFAOYSA-N
XLogP1.76
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-(4-methyl-3-oxopentyl)butanamide with MolForge

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

Launch Full Analysis

Related Compounds

ethane;methane;3-methyl-N-[2-(5-methyl-4-oxohexoxy)ethyl]butanamide
CID 160711041
N-(4-methyl-3-oxopentyl)acetamide
CID 20600831
3-methyl-N-[6-(3-methylbutanoylamino)hexyl]butanamide
CID 3609868
N-[2-(butanoylamino)ethyl]-3-methylbutanamide
CID 108570913
N-(5,5-dimethyl-3-oxohexyl)-3-methylbutanamide
CID 158833418
N-(4-methyl-3-oxopentyl)acetamide;molecular hydrogen
CID 144886744
3-methyl-N-[4-(4-methyl-3-oxopentoxy)-2-oxobutyl]butanamide
CID 162778888
N-(3-aminopropyl)-3-methylbutanamide
CID 23588483
(4-methyl-3-oxopentyl)carbamodithioic acid
CID 163434682
3-methyl-N-[2-[2-[2-[2-(3-methylbutanoylamino)ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 166662987
CID 168891701
CID 168891701
3-methyl-N-(10-oxoundecyl)butanamide
CID 167541538

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(4-methyl-3-oxopentyl)butanamide?
The IUPAC name of 3-methyl-N-(4-methyl-3-oxopentyl)butanamide (CID 153392843) is 3-methyl-N-(4-methyl-3-oxopentyl)butanamide.
What is the SMILES notation for 3-methyl-N-(4-methyl-3-oxopentyl)butanamide?
The canonical SMILES for 3-methyl-N-(4-methyl-3-oxopentyl)butanamide is CC(C)CC(=O)NCCC(=O)C(C)C.
What is the InChIKey of 3-methyl-N-(4-methyl-3-oxopentyl)butanamide?
The InChIKey is RCXCWFDIBMUVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8(2)7-11(14)12-6-5-10(13)9(3)4/h8-9H,5-7H2,1-4H3,(H,12,14).
What are the key properties of 3-methyl-N-(4-methyl-3-oxopentyl)butanamide?
3-methyl-N-(4-methyl-3-oxopentyl)butanamide has a molecular weight of 199.29 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(4-methyl-3-oxopentyl)butanamide is sourced from PubChem (CID 153392843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).