ethoxycyclododecane

C14H28O — CID 11264326

IUPACethoxycyclododecane
SMILESCCOC1CCCCCCCCCCC1
InChIInChI=1S/C14H28O/c1-2-15-14-12-10-8-6-4-3-5-7-9-11-13-14/h14H,2-13H2,1H3
InChIKeyFDNPVQXLGFNHGX-UHFFFAOYSA-N
MW212.38 g/mol
LogP4.70
Rot. Bonds2

About ethoxycyclododecane

ethoxycyclododecane (PubChem CID 11264326) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is ethoxycyclododecane.

Molecular Properties

Compound Nameethoxycyclododecane
PubChem CID11264326
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Nameethoxycyclododecane
SMILESCCOC1CCCCCCCCCCC1
InChIInChI=1S/C14H28O/c1-2-15-14-12-10-8-6-4-3-5-7-9-11-13-14/h14H,2-13H2,1H3
InChIKeyFDNPVQXLGFNHGX-UHFFFAOYSA-N
XLogP4.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze ethoxycyclododecane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethoxycyclododecane?
The IUPAC name of ethoxycyclododecane (CID 11264326) is ethoxycyclododecane.
What is the SMILES notation for ethoxycyclododecane?
The canonical SMILES for ethoxycyclododecane is CCOC1CCCCCCCCCCC1.
What is the InChIKey of ethoxycyclododecane?
The InChIKey is FDNPVQXLGFNHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O/c1-2-15-14-12-10-8-6-4-3-5-7-9-11-13-14/h14H,2-13H2,1H3.
What are the key properties of ethoxycyclododecane?
ethoxycyclododecane has a molecular weight of 212.38 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxycyclododecane is sourced from PubChem (CID 11264326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).