ethyl 2-(oxetan-3-yloxy)pentanoate

C10H18O4 — CID 102605335

IUPACethyl 2-(oxetan-3-yloxy)pentanoate
SMILESCCCC(OC1COC1)C(=O)OCC
InChIInChI=1S/C10H18O4/c1-3-5-9(10(11)13-4-2)14-8-6-12-7-8/h8-9H,3-7H2,1-2H3
InChIKeySAZTVCAAPUJVPL-UHFFFAOYSA-N
MW202.25 g/mol
LogP1.13
Rot. Bonds6

About ethyl 2-(oxetan-3-yloxy)pentanoate

ethyl 2-(oxetan-3-yloxy)pentanoate (PubChem CID 102605335) has the molecular formula C10H18O4 and a molecular weight of 202.25 g/mol. Its IUPAC name is ethyl 2-(oxetan-3-yloxy)pentanoate.

Molecular Properties

Compound Nameethyl 2-(oxetan-3-yloxy)pentanoate
PubChem CID102605335
Molecular FormulaC10H18O4
Molecular Weight202.25 g/mol
Exact Mass202.12
IUPAC Nameethyl 2-(oxetan-3-yloxy)pentanoate
SMILESCCCC(OC1COC1)C(=O)OCC
InChIInChI=1S/C10H18O4/c1-3-5-9(10(11)13-4-2)14-8-6-12-7-8/h8-9H,3-7H2,1-2H3
InChIKeySAZTVCAAPUJVPL-UHFFFAOYSA-N
XLogP1.13
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze ethyl 2-(oxetan-3-yloxy)pentanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-(oxolan-3-yloxy)pentanoate
CID 83038172
methyl 2-(oxetan-3-yloxy)hexanoate
CID 102605289
ethyl 2-piperidin-4-yloxypentanoate
CID 106939245
2-(oxetan-3-yloxy)hexanoic acid
CID 102605290
ethyl 2-[(3S)-piperidin-3-yl]oxypentanoate
CID 106940483
oxetan-3-yl 2-aminopentanoate
CID 102606817
ethyl 2-(oxolan-3-ylmethoxy)pentanoate
CID 83038452
4-(oxetan-3-yloxy)pentanehydrazide
CID 102608445
ethyl 2-(ethylamino)-4-(oxetan-3-yloxy)butanoate
CID 102607501
ethyl 4-(oxetan-3-yloxy)-2-(propylamino)butanoate
CID 102607607
ethyl 2-(2-methylpropanoyloxy)pentanoate
CID 137351273
ethyl 2-(4,4-dimethylcyclohexyl)oxybutanoate
CID 114340349

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(oxetan-3-yloxy)pentanoate?
The IUPAC name of ethyl 2-(oxetan-3-yloxy)pentanoate (CID 102605335) is ethyl 2-(oxetan-3-yloxy)pentanoate.
What is the SMILES notation for ethyl 2-(oxetan-3-yloxy)pentanoate?
The canonical SMILES for ethyl 2-(oxetan-3-yloxy)pentanoate is CCCC(OC1COC1)C(=O)OCC.
What is the InChIKey of ethyl 2-(oxetan-3-yloxy)pentanoate?
The InChIKey is SAZTVCAAPUJVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O4/c1-3-5-9(10(11)13-4-2)14-8-6-12-7-8/h8-9H,3-7H2,1-2H3.
What are the key properties of ethyl 2-(oxetan-3-yloxy)pentanoate?
ethyl 2-(oxetan-3-yloxy)pentanoate has a molecular weight of 202.25 g/mol, XLogP of 1.13, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(oxetan-3-yloxy)pentanoate is sourced from PubChem (CID 102605335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).