4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one

C11H20N2O2 — CID 79572301

IUPAC4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one
SMILESNC1CCCC1CCN1CCOCC1=O
InChIInChI=1S/C11H20N2O2/c12-10-3-1-2-9(10)4-5-13-6-7-15-8-11(13)14/h9-10H,1-8,12H2
InChIKeyPTBJKIKGFOIQBS-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.36
Rot. Bonds3

About 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one

4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one (PubChem CID 79572301) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one.

Molecular Properties

Compound Name4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one
PubChem CID79572301
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one
SMILESNC1CCCC1CCN1CCOCC1=O
InChIInChI=1S/C11H20N2O2/c12-10-3-1-2-9(10)4-5-13-6-7-15-8-11(13)14/h9-10H,1-8,12H2
InChIKeyPTBJKIKGFOIQBS-UHFFFAOYSA-N
XLogP0.36
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one?
The IUPAC name of 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one (CID 79572301) is 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one.
What is the SMILES notation for 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one?
The canonical SMILES for 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one is NC1CCCC1CCN1CCOCC1=O.
What is the InChIKey of 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one?
The InChIKey is PTBJKIKGFOIQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c12-10-3-1-2-9(10)4-5-13-6-7-15-8-11(13)14/h9-10H,1-8,12H2.
What are the key properties of 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one?
4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one has a molecular weight of 212.29 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-aminocyclopentyl)ethyl]morpholin-3-one is sourced from PubChem (CID 79572301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).