1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate

C12H23NO3 — CID 103489239

IUPAC1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate
SMILESCCOCC(C)OC(=O)CNC1CCCC1
InChIInChI=1S/C12H23NO3/c1-3-15-9-10(2)16-12(14)8-13-11-6-4-5-7-11/h10-11,13H,3-9H2,1-2H3
InChIKeyUFYRPAVJFKQKKZ-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.49
Rot. Bonds7

About 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate

1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate (PubChem CID 103489239) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate.

Molecular Properties

Compound Name1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate
PubChem CID103489239
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC Name1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate
SMILESCCOCC(C)OC(=O)CNC1CCCC1
InChIInChI=1S/C12H23NO3/c1-3-15-9-10(2)16-12(14)8-13-11-6-4-5-7-11/h10-11,13H,3-9H2,1-2H3
InChIKeyUFYRPAVJFKQKKZ-UHFFFAOYSA-N
XLogP1.49
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate?
The IUPAC name of 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate (CID 103489239) is 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate.
What is the SMILES notation for 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate?
The canonical SMILES for 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate is CCOCC(C)OC(=O)CNC1CCCC1.
What is the InChIKey of 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate?
The InChIKey is UFYRPAVJFKQKKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-3-15-9-10(2)16-12(14)8-13-11-6-4-5-7-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate?
1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate has a molecular weight of 229.32 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxypropan-2-yl 2-(cyclopentylamino)acetate is sourced from PubChem (CID 103489239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).