ethyl (2R)-2-amino-2-cyclopentylacetate

C9H17NO2 — CID 10888362

IUPACethyl (2R)-2-amino-2-cyclopentylacetate
SMILESCCOC(=O)[C@H](N)C1CCCC1
InChIInChI=1S/C9H17NO2/c1-2-12-9(11)8(10)7-5-3-4-6-7/h7-8H,2-6,10H2,1H3/t8-/m1/s1
InChIKeyQIHMFSRVNXGXQC-MRVPVSSYSA-N
MW171.24 g/mol
LogP1.07
Rot. Bonds3

About ethyl (2R)-2-amino-2-cyclopentylacetate

ethyl (2R)-2-amino-2-cyclopentylacetate (PubChem CID 10888362) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is ethyl (2R)-2-amino-2-cyclopentylacetate.

Molecular Properties

Compound Nameethyl (2R)-2-amino-2-cyclopentylacetate
PubChem CID10888362
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Nameethyl (2R)-2-amino-2-cyclopentylacetate
SMILESCCOC(=O)[C@H](N)C1CCCC1
InChIInChI=1S/C9H17NO2/c1-2-12-9(11)8(10)7-5-3-4-6-7/h7-8H,2-6,10H2,1H3/t8-/m1/s1
InChIKeyQIHMFSRVNXGXQC-MRVPVSSYSA-N
XLogP1.07
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl (2R)-2-amino-2-cyclopentylacetate?
The IUPAC name of ethyl (2R)-2-amino-2-cyclopentylacetate (CID 10888362) is ethyl (2R)-2-amino-2-cyclopentylacetate.
What is the SMILES notation for ethyl (2R)-2-amino-2-cyclopentylacetate?
The canonical SMILES for ethyl (2R)-2-amino-2-cyclopentylacetate is CCOC(=O)[C@H](N)C1CCCC1.
What is the InChIKey of ethyl (2R)-2-amino-2-cyclopentylacetate?
The InChIKey is QIHMFSRVNXGXQC-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-2-12-9(11)8(10)7-5-3-4-6-7/h7-8H,2-6,10H2,1H3/t8-/m1/s1.
What are the key properties of ethyl (2R)-2-amino-2-cyclopentylacetate?
ethyl (2R)-2-amino-2-cyclopentylacetate has a molecular weight of 171.24 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2R)-2-amino-2-cyclopentylacetate is sourced from PubChem (CID 10888362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).