[2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate

C16H21NO5 — CID 2358715

IUPAC[2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
SMILESCOc1ccc(OCC(=O)OCC(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H21NO5/c1-20-13-6-8-14(9-7-13)21-11-16(19)22-10-15(18)17-12-4-2-3-5-12/h6-9,12H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyOLYQFMWVKOPDCK-UHFFFAOYSA-N
MW307.35 g/mol
LogP1.68
Rot. Bonds7

About [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate

[2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate (PubChem CID 2358715) has the molecular formula C16H21NO5 and a molecular weight of 307.35 g/mol. Its IUPAC name is [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate.

Molecular Properties

Compound Name[2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
PubChem CID2358715
Molecular FormulaC16H21NO5
Molecular Weight307.35 g/mol
Exact Mass307.14
IUPAC Name[2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate
SMILESCOc1ccc(OCC(=O)OCC(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H21NO5/c1-20-13-6-8-14(9-7-13)21-11-16(19)22-10-15(18)17-12-4-2-3-5-12/h6-9,12H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyOLYQFMWVKOPDCK-UHFFFAOYSA-N
XLogP1.68
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate 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-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate?
The IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate (CID 2358715) is [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate.
What is the SMILES notation for [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate?
The canonical SMILES for [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate is COc1ccc(OCC(=O)OCC(=O)NC2CCCC2)cc1.
What is the InChIKey of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate?
The InChIKey is OLYQFMWVKOPDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO5/c1-20-13-6-8-14(9-7-13)21-11-16(19)22-10-15(18)17-12-4-2-3-5-12/h6-9,12H,2-5,10-11H2,1H3,(H,17,18).
What are the key properties of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate?
[2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate has a molecular weight of 307.35 g/mol, XLogP of 1.68, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopentylamino)-2-oxoethyl] 2-(4-methoxyphenoxy)acetate is sourced from PubChem (CID 2358715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).