2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide

C13H22N2O2 — CID 106277896

IUPAC2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide
SMILESCC(C)(CN1C2CCCC1CC(=O)C2)C(N)=O
InChIInChI=1S/C13H22N2O2/c1-13(2,12(14)17)8-15-9-4-3-5-10(15)7-11(16)6-9/h9-10H,3-8H2,1-2H3,(H2,14,17)
InChIKeyODMBPUVZAJCACE-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.08
Rot. Bonds3

About 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide

2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide (PubChem CID 106277896) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide
PubChem CID106277896
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide
SMILESCC(C)(CN1C2CCCC1CC(=O)C2)C(N)=O
InChIInChI=1S/C13H22N2O2/c1-13(2,12(14)17)8-15-9-4-3-5-10(15)7-11(16)6-9/h9-10H,3-8H2,1-2H3,(H2,14,17)
InChIKeyODMBPUVZAJCACE-UHFFFAOYSA-N
XLogP1.08
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide 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

N,2,2-trimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide
CID 114167443
9-(2-cyclopentylethyl)-9-azabicyclo[3.3.1]nonan-3-one
CID 62712336
9-(2-methyl-2-thiophen-2-ylpropyl)-9-azabicyclo[3.3.1]nonan-3-one
CID 80527761
8-[2-(dimethylamino)-2-methylpropyl]-8-azabicyclo[3.2.1]octan-3-one
CID 62740860
9-[2-(1-methylpiperidin-4-yl)ethyl]-9-azabicyclo[3.3.1]nonan-3-one
CID 114516711
9-(2-methylpropyl)-9-azabicyclo[3.3.1]nonan-3-one
CID 62713752
tert-butyl (1S,5S)-3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylate
CID 86811260
3-methyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)butanamide
CID 106098520
ethane;9-hydroxy-9-azabicyclo[3.3.1]nonan-3-one
CID 159223821
4-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)butanamide
CID 62740306
3-(3-bromo-2-oxopyrrolidin-1-yl)-2,2-dimethylpropanamide
CID 106279166
9-(7-methyloctyl)-9-azabicyclo[3.3.1]nonan-3-one
CID 114004422

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide?
The IUPAC name of 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide (CID 106277896) is 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide is CC(C)(CN1C2CCCC1CC(=O)C2)C(N)=O.
What is the InChIKey of 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide?
The InChIKey is ODMBPUVZAJCACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-13(2,12(14)17)8-15-9-4-3-5-10(15)7-11(16)6-9/h9-10H,3-8H2,1-2H3,(H2,14,17).
What are the key properties of 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide?
2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide has a molecular weight of 238.33 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide is sourced from PubChem (CID 106277896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).