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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Related Compounds

8-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-8-azabicyclo[3.2.1]octan-3-one
CID 113408769
N-ethyl-N-methyl-2-(3-oxo-8-azabicyclo[3.2.1]octan-8-yl)propanamide
CID 103113464
N,N-dimethyl-2-(3-oxo-9-azabicyclo[3.3.1]nonan-9-yl)propanamide
CID 62714663
(1S,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-one
CID 6338849
8-methyl-8-azabicyclo[3.2.1]octan-3-one;hydrobromide
CID 3057566
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methylpropanamide
CID 66291565
N-ethyl-2-[3-(methylamino)-8-azabicyclo[3.2.1]octan-8-yl]propanamide
CID 62738654
(2R)-2-[4,7-bis[(2R)-1-(methylamino)-1-oxopropan-2-yl]-1,4,7-triazonan-1-yl]-N-methylpropanamide
CID 177439425
2-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)propanehydrazide
CID 63770170
9-(3,3-dimethylbutan-2-yl)-9-azabicyclo[3.3.1]nonan-3-one
CID 104830042
2-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-N-(3-methylbutyl)propanamide
CID 55149467
2-(3-ethylpyrrolidin-1-yl)-N-methylpropanamide
CID 126990123

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).