ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate

C14H25NO3 — CID 54899097

IUPACethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate
SMILESCCCN(CC(=O)OCC)C(=O)CC1CCCC1
InChIInChI=1S/C14H25NO3/c1-3-9-15(11-14(17)18-4-2)13(16)10-12-7-5-6-8-12/h12H,3-11H2,1-2H3
InChIKeyPSOYCMNHDCRCGO-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.37
Rot. Bonds7

About ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate

ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate (PubChem CID 54899097) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate.

Molecular Properties

Compound Nameethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate
PubChem CID54899097
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Nameethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate
SMILESCCCN(CC(=O)OCC)C(=O)CC1CCCC1
InChIInChI=1S/C14H25NO3/c1-3-9-15(11-14(17)18-4-2)13(16)10-12-7-5-6-8-12/h12H,3-11H2,1-2H3
InChIKeyPSOYCMNHDCRCGO-UHFFFAOYSA-N
XLogP2.37
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-sulfanylideneethyl)-2-cyclobutyl-N-propylacetamide
CID 103163676
ethyl 2-[(2-cycloheptylacetyl)-prop-2-enylamino]acetate
CID 115681468
ethyl 2-[bicyclo[3.1.0]hexane-6-carbonyl(propyl)amino]acetate
CID 79796106
ethyl 2-[cyclohexylmethyl(propyl)amino]acetate
CID 61238525
N-(3-aminopropyl)-2-cycloheptyl-N-propylacetamide
CID 114456956
N-(cyanomethyl)-2-cyclopentyl-N-propylacetamide
CID 61381682
ethyl 2-[(4-methylcyclohexanecarbonyl)-propylamino]acetate
CID 79005878
N,N-dibutyl-2-cyclopentylacetamide
CID 13315634
methyl 2-[[2-(1,1-dioxothiolan-3-yl)acetyl]-propylamino]acetate
CID 55006150
ethyl 2-[3-(cyclopentanecarbonylamino)butanoyl-propylamino]acetate
CID 71879865
ethyl 2-[benzyl-(2-cyclobutylacetyl)amino]acetate
CID 103707142
ethyl 2-[(4-methylpiperidine-1-carbonyl)-propylamino]acetate
CID 79162765

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate?
The IUPAC name of ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate (CID 54899097) is ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate.
What is the SMILES notation for ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate?
The canonical SMILES for ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate is CCCN(CC(=O)OCC)C(=O)CC1CCCC1.
What is the InChIKey of ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate?
The InChIKey is PSOYCMNHDCRCGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-3-9-15(11-14(17)18-4-2)13(16)10-12-7-5-6-8-12/h12H,3-11H2,1-2H3.
What are the key properties of ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate?
ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate has a molecular weight of 255.36 g/mol, XLogP of 2.37, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[(2-cyclopentylacetyl)-propylamino]acetate is sourced from PubChem (CID 54899097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).