[2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate

C15H19NO4 — CID 2507035

IUPAC[2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate
SMILESO=C(COC(=O)COc1ccccc1)NC1CCCC1
InChIInChI=1S/C15H19NO4/c17-14(16-12-6-4-5-7-12)10-20-15(18)11-19-13-8-2-1-3-9-13/h1-3,8-9,12H,4-7,10-11H2,(H,16,17)
InChIKeyHTKSUNHOUFLCSV-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.67
Rot. Bonds6

About [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate

[2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate (PubChem CID 2507035) has the molecular formula C15H19NO4 and a molecular weight of 277.32 g/mol. Its IUPAC name is [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate.

Molecular Properties

Compound Name[2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate
PubChem CID2507035
Molecular FormulaC15H19NO4
Molecular Weight277.32 g/mol
Exact Mass277.13
IUPAC Name[2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate
SMILESO=C(COC(=O)COc1ccccc1)NC1CCCC1
InChIInChI=1S/C15H19NO4/c17-14(16-12-6-4-5-7-12)10-20-15(18)11-19-13-8-2-1-3-9-13/h1-3,8-9,12H,4-7,10-11H2,(H,16,17)
InChIKeyHTKSUNHOUFLCSV-UHFFFAOYSA-N
XLogP1.67
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-2-phenoxyacetamide
CID 832666
N-cyclooctyl-2-(4-methoxyphenoxy)acetamide
CID 774454
3-Methyl-2-(2-phenoxyacetamido)butanoic acid
CID 2942249
N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 80619
(2S)-3-methyl-2-(2-phenoxyacetamido)butanoic acid
CID 749024
[2-(Cyclopropylamino)-2-oxoethyl] 2-(2-methylphenoxy)acetate
CID 2344647
[2-(Cyclopentylamino)-2-oxoethyl] 2-(4-bromophenoxy)acetate
CID 2376778
[2-[2-(Cyclohexen-1-yl)ethylamino]-2-oxoethyl] 2-phenoxyacetate
CID 2506754
[1-(Cyclopentylamino)-1-oxopropan-2-yl] 2-phenoxyacetate
CID 4216860
2-(4-methoxyphenoxy)-N-(6-{[(4-methoxyphenoxy)acetyl]amino}hexyl)acetamide
CID 4558233
N-cyclopentyl-2-(2-hydroxyphenoxy)acetamide
CID 8002585
[2-(Cyclopentylamino)-2-oxoethyl] 3-(4-methylphenoxy)propanoate
CID 9139575

Frequently Asked Questions

What is the IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate?
The IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate (CID 2507035) is [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate.
What is the SMILES notation for [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate?
The canonical SMILES for [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate is O=C(COC(=O)COc1ccccc1)NC1CCCC1.
What is the InChIKey of [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate?
The InChIKey is HTKSUNHOUFLCSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO4/c17-14(16-12-6-4-5-7-12)10-20-15(18)11-19-13-8-2-1-3-9-13/h1-3,8-9,12H,4-7,10-11H2,(H,16,17).
What are the key properties of [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate?
[2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate has a molecular weight of 277.32 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopentylamino)-2-oxoethyl] 2-phenoxyacetate is sourced from PubChem (CID 2507035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).