2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one

C10H15NO2 — CID 130769925

IUPAC2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one
SMILESO=C1CCCC1N1CC2CC1CO2
InChIInChI=1S/C10H15NO2/c12-10-3-1-2-9(10)11-5-8-4-7(11)6-13-8/h7-9H,1-6H2
InChIKeyMFEMHZGHIQIEML-UHFFFAOYSA-N
MW181.23 g/mol
LogP0.58
Rot. Bonds1

About 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one

2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one (PubChem CID 130769925) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one.

Molecular Properties

Compound Name2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one
PubChem CID130769925
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one
SMILESO=C1CCCC1N1CC2CC1CO2
InChIInChI=1S/C10H15NO2/c12-10-3-1-2-9(10)11-5-8-4-7(11)6-13-8/h7-9H,1-6H2
InChIKeyMFEMHZGHIQIEML-UHFFFAOYSA-N
XLogP0.58
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one 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

5-Propyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 20748977
5-Methyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 22084788
(1S,4R)-5-methyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 59807433
(1R,4S)-5-methyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 59807439
(1S,4S)-5-methyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 68275129
(1R,4R)-5-methyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 89242460
(1S,4S)-5-ethyl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 89861394
(1R,4R)-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 118148053
5-Propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 118148095
5-(2-Methylpropyl)-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 130318530
1-(2-Oxa-5-azabicyclo[2.2.1]heptan-5-yl)propan-2-one
CID 131091838
(1S,4S)-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptan-3-one
CID 134213250

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one?
The IUPAC name of 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one (CID 130769925) is 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one.
What is the SMILES notation for 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one?
The canonical SMILES for 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one is O=C1CCCC1N1CC2CC1CO2.
What is the InChIKey of 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one?
The InChIKey is MFEMHZGHIQIEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c12-10-3-1-2-9(10)11-5-8-4-7(11)6-13-8/h7-9H,1-6H2.
What are the key properties of 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one?
2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one has a molecular weight of 181.23 g/mol, XLogP of 0.58, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)cyclopentan-1-one is sourced from PubChem (CID 130769925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).