ethenoxyethane;1-ethenoxy-2-methylpropane

C10H20O2 — CID 19098017

IUPACethenoxyethane;1-ethenoxy-2-methylpropane
SMILESC=COCC.C=COCC(C)C
InChIInChI=1S/C6H12O.C4H8O/c1-4-7-5-6(2)3;1-3-5-4-2/h4,6H,1,5H2,2-3H3;3H,1,4H2,2H3
InChIKeyCNGMVONDIHVRAM-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.97
Rot. Bonds5

About ethenoxyethane;1-ethenoxy-2-methylpropane

ethenoxyethane;1-ethenoxy-2-methylpropane (PubChem CID 19098017) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is ethenoxyethane;1-ethenoxy-2-methylpropane.

Molecular Properties

Compound Nameethenoxyethane;1-ethenoxy-2-methylpropane
PubChem CID19098017
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Nameethenoxyethane;1-ethenoxy-2-methylpropane
SMILESC=COCC.C=COCC(C)C
InChIInChI=1S/C6H12O.C4H8O/c1-4-7-5-6(2)3;1-3-5-4-2/h4,6H,1,5H2,2-3H3;3H,1,4H2,2H3
InChIKeyCNGMVONDIHVRAM-UHFFFAOYSA-N
XLogP2.97
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze ethenoxyethane;1-ethenoxy-2-methylpropane 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 ethenoxyethane;1-ethenoxy-2-methylpropane?
The IUPAC name of ethenoxyethane;1-ethenoxy-2-methylpropane (CID 19098017) is ethenoxyethane;1-ethenoxy-2-methylpropane.
What is the SMILES notation for ethenoxyethane;1-ethenoxy-2-methylpropane?
The canonical SMILES for ethenoxyethane;1-ethenoxy-2-methylpropane is C=COCC.C=COCC(C)C.
What is the InChIKey of ethenoxyethane;1-ethenoxy-2-methylpropane?
The InChIKey is CNGMVONDIHVRAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.C4H8O/c1-4-7-5-6(2)3;1-3-5-4-2/h4,6H,1,5H2,2-3H3;3H,1,4H2,2H3.
What are the key properties of ethenoxyethane;1-ethenoxy-2-methylpropane?
ethenoxyethane;1-ethenoxy-2-methylpropane has a molecular weight of 172.27 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenoxyethane;1-ethenoxy-2-methylpropane is sourced from PubChem (CID 19098017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).