N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide

C12H20N2O2 — CID 62739966

IUPACN,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
SMILESCN(C)C(=O)CCN1C2CCC1CC(=O)C2
InChIInChI=1S/C12H20N2O2/c1-13(2)12(16)5-6-14-9-3-4-10(14)8-11(15)7-9/h9-10H,3-8H2,1-2H3
InChIKeyQQICZXBLHZFFII-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.66
Rot. Bonds3

About N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide

N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide (PubChem CID 62739966) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide.

Molecular Properties

Compound NameN,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
PubChem CID62739966
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
SMILESCN(C)C(=O)CCN1C2CCC1CC(=O)C2
InChIInChI=1S/C12H20N2O2/c1-13(2)12(16)5-6-14-9-3-4-10(14)8-11(15)7-9/h9-10H,3-8H2,1-2H3
InChIKeyQQICZXBLHZFFII-UHFFFAOYSA-N
XLogP0.66
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
The IUPAC name of N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide (CID 62739966) is N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide.
What is the SMILES notation for N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
The canonical SMILES for N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide is CN(C)C(=O)CCN1C2CCC1CC(=O)C2.
What is the InChIKey of N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
The InChIKey is QQICZXBLHZFFII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-13(2)12(16)5-6-14-9-3-4-10(14)8-11(15)7-9/h9-10H,3-8H2,1-2H3.
What are the key properties of N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide has a molecular weight of 224.30 g/mol, XLogP of 0.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide is sourced from PubChem (CID 62739966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).