2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one

C14H27NO2 — CID 79568654

IUPAC2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one
SMILESCOCCN(CCC1CCCC1=O)CC(C)C
InChIInChI=1S/C14H27NO2/c1-12(2)11-15(9-10-17-3)8-7-13-5-4-6-14(13)16/h12-13H,4-11H2,1-3H3
InChIKeyJHLYFWABVPOFFW-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.35
Rot. Bonds8

About 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one

2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one (PubChem CID 79568654) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one.

Molecular Properties

Compound Name2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one
PubChem CID79568654
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one
SMILESCOCCN(CCC1CCCC1=O)CC(C)C
InChIInChI=1S/C14H27NO2/c1-12(2)11-15(9-10-17-3)8-7-13-5-4-6-14(13)16/h12-13H,4-11H2,1-3H3
InChIKeyJHLYFWABVPOFFW-UHFFFAOYSA-N
XLogP2.35
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]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

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one?
The IUPAC name of 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one (CID 79568654) is 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one.
What is the SMILES notation for 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one?
The canonical SMILES for 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one is COCCN(CCC1CCCC1=O)CC(C)C.
What is the InChIKey of 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one?
The InChIKey is JHLYFWABVPOFFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-12(2)11-15(9-10-17-3)8-7-13-5-4-6-14(13)16/h12-13H,4-11H2,1-3H3.
What are the key properties of 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one?
2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one has a molecular weight of 241.37 g/mol, XLogP of 2.35, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-methoxyethyl(2-methylpropyl)amino]ethyl]cyclopentan-1-one is sourced from PubChem (CID 79568654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).