(2-ethylcyclohexyl) 2-(cyclopentylamino)acetate

C15H27NO2 — CID 61277044

IUPAC(2-ethylcyclohexyl) 2-(cyclopentylamino)acetate
SMILESCCC1CCCCC1OC(=O)CNC1CCCC1
InChIInChI=1S/C15H27NO2/c1-2-12-7-3-6-10-14(12)18-15(17)11-16-13-8-4-5-9-13/h12-14,16H,2-11H2,1H3
InChIKeyLUTKQKRPMWVJNN-UHFFFAOYSA-N
MW253.39 g/mol
LogP3.03
Rot. Bonds5

About (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate

(2-ethylcyclohexyl) 2-(cyclopentylamino)acetate (PubChem CID 61277044) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate.

Molecular Properties

Compound Name(2-ethylcyclohexyl) 2-(cyclopentylamino)acetate
PubChem CID61277044
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name(2-ethylcyclohexyl) 2-(cyclopentylamino)acetate
SMILESCCC1CCCCC1OC(=O)CNC1CCCC1
InChIInChI=1S/C15H27NO2/c1-2-12-7-3-6-10-14(12)18-15(17)11-16-13-8-4-5-9-13/h12-14,16H,2-11H2,1H3
InChIKeyLUTKQKRPMWVJNN-UHFFFAOYSA-N
XLogP3.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate?
The IUPAC name of (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate (CID 61277044) is (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate.
What is the SMILES notation for (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate?
The canonical SMILES for (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate is CCC1CCCCC1OC(=O)CNC1CCCC1.
What is the InChIKey of (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate?
The InChIKey is LUTKQKRPMWVJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-2-12-7-3-6-10-14(12)18-15(17)11-16-13-8-4-5-9-13/h12-14,16H,2-11H2,1H3.
What are the key properties of (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate?
(2-ethylcyclohexyl) 2-(cyclopentylamino)acetate has a molecular weight of 253.39 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylcyclohexyl) 2-(cyclopentylamino)acetate is sourced from PubChem (CID 61277044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).