ethyl 2-[cyclohexyl(ethyl)amino]acetate

C12H23NO2 — CID 28878886

IUPACethyl 2-[cyclohexyl(ethyl)amino]acetate
SMILESCCOC(=O)CN(CC)C1CCCCC1
InChIInChI=1S/C12H23NO2/c1-3-13(10-12(14)15-4-2)11-8-6-5-7-9-11/h11H,3-10H2,1-2H3
InChIKeyRDLANXWJSTTZAS-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.20
Rot. Bonds5

About ethyl 2-[cyclohexyl(ethyl)amino]acetate

ethyl 2-[cyclohexyl(ethyl)amino]acetate (PubChem CID 28878886) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is ethyl 2-[cyclohexyl(ethyl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[cyclohexyl(ethyl)amino]acetate
PubChem CID28878886
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Nameethyl 2-[cyclohexyl(ethyl)amino]acetate
SMILESCCOC(=O)CN(CC)C1CCCCC1
InChIInChI=1S/C12H23NO2/c1-3-13(10-12(14)15-4-2)11-8-6-5-7-9-11/h11H,3-10H2,1-2H3
InChIKeyRDLANXWJSTTZAS-UHFFFAOYSA-N
XLogP2.20
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[cyclohexyl(ethyl)amino]acetate?
The IUPAC name of ethyl 2-[cyclohexyl(ethyl)amino]acetate (CID 28878886) is ethyl 2-[cyclohexyl(ethyl)amino]acetate.
What is the SMILES notation for ethyl 2-[cyclohexyl(ethyl)amino]acetate?
The canonical SMILES for ethyl 2-[cyclohexyl(ethyl)amino]acetate is CCOC(=O)CN(CC)C1CCCCC1.
What is the InChIKey of ethyl 2-[cyclohexyl(ethyl)amino]acetate?
The InChIKey is RDLANXWJSTTZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-13(10-12(14)15-4-2)11-8-6-5-7-9-11/h11H,3-10H2,1-2H3.
What are the key properties of ethyl 2-[cyclohexyl(ethyl)amino]acetate?
ethyl 2-[cyclohexyl(ethyl)amino]acetate has a molecular weight of 213.32 g/mol, XLogP of 2.20, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[cyclohexyl(ethyl)amino]acetate is sourced from PubChem (CID 28878886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).