ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate

C14H26N2O3 — CID 62026180

IUPACethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate
SMILESCCOC(=O)CN(CC)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C14H26N2O3/c1-4-16(10-13(17)19-5-2)11(3)14(18)15-12-8-6-7-9-12/h11-12H,4-10H2,1-3H3,(H,15,18)
InChIKeyKIEASTMKMIQPOY-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.32
Rot. Bonds7

About ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate

ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate (PubChem CID 62026180) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate.

Molecular Properties

Compound Nameethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate
PubChem CID62026180
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Nameethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate
SMILESCCOC(=O)CN(CC)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C14H26N2O3/c1-4-16(10-13(17)19-5-2)11(3)14(18)15-12-8-6-7-9-12/h11-12H,4-10H2,1-3H3,(H,15,18)
InChIKeyKIEASTMKMIQPOY-UHFFFAOYSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]-propylamino]acetate
CID 62011561
ethyl 2-[[3-(cyclohexylamino)-3-oxopropyl]-propan-2-ylamino]acetate
CID 62028525
2-[carboxymethyl-[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 55244223
2-[(3-amino-2,2-dimethylpropyl)-ethylamino]-N-cyclopentylpropanamide
CID 79667958
ethyl 2-[[2-(cyclopentylamino)acetyl]-propan-2-ylamino]acetate
CID 54916597
2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-cyclopentylpropanamide
CID 51171045
2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-cyclohexylpropanamide
CID 51171048
methyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]-methylamino]acetate
CID 60670343
ethyl 2-[[3-(cyclohexylamino)-3-oxopropyl]-ethylamino]acetate
CID 62026563
ethyl 2-[cyclopropylcarbamoyl(ethyl)amino]acetate
CID 62700813
3-[[1-(cyclopropylamino)-1-oxopropan-2-yl]-ethylamino]-2-methylpropanoic acid
CID 62853862
ethyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]amino]propanoate
CID 61498920

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate?
The IUPAC name of ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate (CID 62026180) is ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate.
What is the SMILES notation for ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate?
The canonical SMILES for ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate is CCOC(=O)CN(CC)C(C)C(=O)NC1CCCC1.
What is the InChIKey of ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate?
The InChIKey is KIEASTMKMIQPOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-4-16(10-13(17)19-5-2)11(3)14(18)15-12-8-6-7-9-12/h11-12H,4-10H2,1-3H3,(H,15,18).
What are the key properties of ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate?
ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate has a molecular weight of 270.37 g/mol, XLogP of 1.32, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]-ethylamino]acetate is sourced from PubChem (CID 62026180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).