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

C15H18FNO4 — CID 7791687

IUPAC[2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate
SMILESO=C(COC(=O)COc1ccc(F)cc1)NC1CCCC1
InChIInChI=1S/C15H18FNO4/c16-11-5-7-13(8-6-11)20-10-15(19)21-9-14(18)17-12-3-1-2-4-12/h5-8,12H,1-4,9-10H2,(H,17,18)
InChIKeyAHAAXHKDDDZHQC-UHFFFAOYSA-N
MW295.31 g/mol
LogP1.81
Rot. Bonds6

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

[2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate (PubChem CID 7791687) has the molecular formula C15H18FNO4 and a molecular weight of 295.31 g/mol. Its IUPAC name is [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate.

Molecular Properties

Compound Name[2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate
PubChem CID7791687
Molecular FormulaC15H18FNO4
Molecular Weight295.31 g/mol
Exact Mass295.12
IUPAC Name[2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate
SMILESO=C(COC(=O)COc1ccc(F)cc1)NC1CCCC1
InChIInChI=1S/C15H18FNO4/c16-11-5-7-13(8-6-11)20-10-15(19)21-9-14(18)17-12-3-1-2-4-12/h5-8,12H,1-4,9-10H2,(H,17,18)
InChIKeyAHAAXHKDDDZHQC-UHFFFAOYSA-N
XLogP1.81
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.31
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 2-(4-fluorophenoxy)acetate
CID 7791504
[2-(cyclopentylamino)-2-oxoethyl] 2-(4-anilinophenoxy)acetate
CID 7149623
[2-(cyclohexylamino)-2-oxoethyl] 2-(4-propanoylphenoxy)acetate
CID 7855189
N-cyclohexyl-5-(4-fluorophenoxy)-4-oxopentanamide
CID 159106921
[2-(cyclopentylamino)-2-oxoethyl] 2-[(4-fluorophenyl)sulfonylamino]oxyacetate
CID 7883785
[2-(cyclooctylamino)-2-oxoethyl] 2-(3,5-dimethylphenoxy)acetate
CID 23884530
[2-(methylcarbamoylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate
CID 7791448
[2-(cyclopentylamino)-2-oxoethyl] 2-(2-propoxyphenoxy)acetate
CID 7791219
N-cyclododecyl-2-(4-methylphenoxy)acetamide
CID 2788426
2-(4-chlorophenoxy)-N-cyclooctylacetamide
CID 875180
N-cyclohexyl-2-(4-iodophenoxy)acetamide
CID 1313853
N-cyclopentyl-2-[4-(hydroxymethyl)phenoxy]acetamide
CID 28561633

Frequently Asked Questions

What is the IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate?
The IUPAC name of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate (CID 7791687) is [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate.
What is the SMILES notation for [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate?
The canonical SMILES for [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate is O=C(COC(=O)COc1ccc(F)cc1)NC1CCCC1.
What is the InChIKey of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate?
The InChIKey is AHAAXHKDDDZHQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FNO4/c16-11-5-7-13(8-6-11)20-10-15(19)21-9-14(18)17-12-3-1-2-4-12/h5-8,12H,1-4,9-10H2,(H,17,18).
What are the key properties of [2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate?
[2-(cyclopentylamino)-2-oxoethyl] 2-(4-fluorophenoxy)acetate has a molecular weight of 295.31 g/mol, XLogP of 1.81, 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-(4-fluorophenoxy)acetate is sourced from PubChem (CID 7791687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).