ethyl 2-(3-aminocyclopentyl)oxyacetate

C9H17NO3 — CID 106940565

IUPACethyl 2-(3-aminocyclopentyl)oxyacetate
SMILESCCOC(=O)COC1CCC(N)C1
InChIInChI=1S/C9H17NO3/c1-2-12-9(11)6-13-8-4-3-7(10)5-8/h7-8H,2-6,10H2,1H3
InChIKeySRXPCMVEZAUTTK-UHFFFAOYSA-N
MW187.24 g/mol
LogP0.45
Rot. Bonds4

About ethyl 2-(3-aminocyclopentyl)oxyacetate

ethyl 2-(3-aminocyclopentyl)oxyacetate (PubChem CID 106940565) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is ethyl 2-(3-aminocyclopentyl)oxyacetate.

Molecular Properties

Compound Nameethyl 2-(3-aminocyclopentyl)oxyacetate
PubChem CID106940565
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC Nameethyl 2-(3-aminocyclopentyl)oxyacetate
SMILESCCOC(=O)COC1CCC(N)C1
InChIInChI=1S/C9H17NO3/c1-2-12-9(11)6-13-8-4-3-7(10)5-8/h7-8H,2-6,10H2,1H3
InChIKeySRXPCMVEZAUTTK-UHFFFAOYSA-N
XLogP0.45
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminocyclopentyl)oxy-N,N-dimethylacetamide
CID 79465990
ethyl 2-(1,1-dioxothian-4-yl)oxyacetate
CID 166884865
2-(3-aminocyclopentyl)oxy-1-piperidin-1-ylethanone
CID 79464849
2-(3-aminocyclopentyl)oxy-N-(cyclopropylmethyl)acetamide
CID 79465996
2-(3-aminocyclopentyl)oxy-N-(3-methylbutan-2-yl)acetamide
CID 79466089
2-(3-aminocyclopentyl)oxy-1-morpholin-4-ylethanone
CID 79464948
2-(3-aminocyclopentyl)oxy-N-(4-methylphenyl)acetamide
CID 79458232
ethyl 2-(2-adamantyloxy)acetate
CID 23009659
2-(4-aminocyclohexyl)oxyacetamide
CID 62806870
3-(2-ethoxyethoxy)cyclopentan-1-amine
CID 79465467
CID 58729260
CID 58729260
2-(3-aminocyclopentyl)oxy-N-(oxan-4-yl)acetamide
CID 79465168

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(3-aminocyclopentyl)oxyacetate?
The IUPAC name of ethyl 2-(3-aminocyclopentyl)oxyacetate (CID 106940565) is ethyl 2-(3-aminocyclopentyl)oxyacetate.
What is the SMILES notation for ethyl 2-(3-aminocyclopentyl)oxyacetate?
The canonical SMILES for ethyl 2-(3-aminocyclopentyl)oxyacetate is CCOC(=O)COC1CCC(N)C1.
What is the InChIKey of ethyl 2-(3-aminocyclopentyl)oxyacetate?
The InChIKey is SRXPCMVEZAUTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO3/c1-2-12-9(11)6-13-8-4-3-7(10)5-8/h7-8H,2-6,10H2,1H3.
What are the key properties of ethyl 2-(3-aminocyclopentyl)oxyacetate?
ethyl 2-(3-aminocyclopentyl)oxyacetate has a molecular weight of 187.24 g/mol, XLogP of 0.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(3-aminocyclopentyl)oxyacetate is sourced from PubChem (CID 106940565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).