cyclopentyl 2-ethoxypropanoate

C10H18O3 — CID 173270406

IUPACcyclopentyl 2-ethoxypropanoate
SMILESCCOC(C)C(=O)OC1CCCC1
InChIInChI=1S/C10H18O3/c1-3-12-8(2)10(11)13-9-6-4-5-7-9/h8-9H,3-7H2,1-2H3
InChIKeyDJFPRZSRTVORJH-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.90
Rot. Bonds4

About cyclopentyl 2-ethoxypropanoate

cyclopentyl 2-ethoxypropanoate (PubChem CID 173270406) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is cyclopentyl 2-ethoxypropanoate.

Molecular Properties

Compound Namecyclopentyl 2-ethoxypropanoate
PubChem CID173270406
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Namecyclopentyl 2-ethoxypropanoate
SMILESCCOC(C)C(=O)OC1CCCC1
InChIInChI=1S/C10H18O3/c1-3-12-8(2)10(11)13-9-6-4-5-7-9/h8-9H,3-7H2,1-2H3
InChIKeyDJFPRZSRTVORJH-UHFFFAOYSA-N
XLogP1.90
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

cyclohexyl 2-ethoxypentanoate
CID 70132370
cyclobutyl 2,3-dimethylpentanoate
CID 174713613
cycloheptyl 3-amino-2-methylpropanoate
CID 62668819
cyclopentyl 2-aminobutanoate;hydrochloride
CID 175315314
[(2S)-1-cyclohexyloxy-1-oxopropan-2-yl]azanium
CID 86325429
cycloheptyl 2-aminopropanoate;hydrochloride
CID 74957485
cyclopropyl 2-methylpropanoate
CID 54511576
cyclohexyl 3-iodo-2-methylpropanoate
CID 155283171
cycloheptyl (2R)-2-amino-4-methylpentanoate
CID 78976122
cyclopentyl 2-aminobutanoate;molecular hydrogen
CID 143574438
cyclopentyl 2-aminopentanoate
CID 61278203
cyclohexyl (4-methoxycarbonyloxycyclohexyl) carbonate
CID 23066096

Frequently Asked Questions

What is the IUPAC name of cyclopentyl 2-ethoxypropanoate?
The IUPAC name of cyclopentyl 2-ethoxypropanoate (CID 173270406) is cyclopentyl 2-ethoxypropanoate.
What is the SMILES notation for cyclopentyl 2-ethoxypropanoate?
The canonical SMILES for cyclopentyl 2-ethoxypropanoate is CCOC(C)C(=O)OC1CCCC1.
What is the InChIKey of cyclopentyl 2-ethoxypropanoate?
The InChIKey is DJFPRZSRTVORJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-3-12-8(2)10(11)13-9-6-4-5-7-9/h8-9H,3-7H2,1-2H3.
What are the key properties of cyclopentyl 2-ethoxypropanoate?
cyclopentyl 2-ethoxypropanoate has a molecular weight of 186.25 g/mol, XLogP of 1.90, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl 2-ethoxypropanoate is sourced from PubChem (CID 173270406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).