N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide

C11H18N2O2 — CID 62739455

IUPACN-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
SMILESCNC(=O)C(C)N1C2CCC1CC(=O)C2
InChIInChI=1S/C11H18N2O2/c1-7(11(15)12-2)13-8-3-4-9(13)6-10(14)5-8/h7-9H,3-6H2,1-2H3,(H,12,15)
InChIKeyUUUCPRIASZIEBN-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.32
Rot. Bonds2

About N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide

N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide (PubChem CID 62739455) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide.

Molecular Properties

Compound NameN-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
PubChem CID62739455
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
SMILESCNC(=O)C(C)N1C2CCC1CC(=O)C2
InChIInChI=1S/C11H18N2O2/c1-7(11(15)12-2)13-8-3-4-9(13)6-10(14)5-8/h7-9H,3-6H2,1-2H3,(H,12,15)
InChIKeyUUUCPRIASZIEBN-UHFFFAOYSA-N
XLogP0.32
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
The IUPAC name of N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide (CID 62739455) is N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide.
What is the SMILES notation for N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
The canonical SMILES for N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide is CNC(=O)C(C)N1C2CCC1CC(=O)C2.
What is the InChIKey of N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
The InChIKey is UUUCPRIASZIEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-7(11(15)12-2)13-8-3-4-9(13)6-10(14)5-8/h7-9H,3-6H2,1-2H3,(H,12,15).
What are the key properties of N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide?
N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide has a molecular weight of 210.28 g/mol, XLogP of 0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide is sourced from PubChem (CID 62739455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).