1-ethenoxy-4-(2-methoxyethyl)benzene

C11H14O2 — CID 66366359

IUPAC1-ethenoxy-4-(2-methoxyethyl)benzene
SMILESC=COc1ccc(CCOC)cc1
InChIInChI=1S/C11H14O2/c1-3-13-11-6-4-10(5-7-11)8-9-12-2/h3-7H,1,8-9H2,2H3
InChIKeyNYRYTXRKAILFDG-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.40
Rot. Bonds5

About 1-ethenoxy-4-(2-methoxyethyl)benzene

1-ethenoxy-4-(2-methoxyethyl)benzene (PubChem CID 66366359) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 1-ethenoxy-4-(2-methoxyethyl)benzene.

Molecular Properties

Compound Name1-ethenoxy-4-(2-methoxyethyl)benzene
PubChem CID66366359
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name1-ethenoxy-4-(2-methoxyethyl)benzene
SMILESC=COc1ccc(CCOC)cc1
InChIInChI=1S/C11H14O2/c1-3-13-11-6-4-10(5-7-11)8-9-12-2/h3-7H,1,8-9H2,2H3
InChIKeyNYRYTXRKAILFDG-UHFFFAOYSA-N
XLogP2.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-ethenoxy-4-(2-methoxyethyl)benzene?
The IUPAC name of 1-ethenoxy-4-(2-methoxyethyl)benzene (CID 66366359) is 1-ethenoxy-4-(2-methoxyethyl)benzene.
What is the SMILES notation for 1-ethenoxy-4-(2-methoxyethyl)benzene?
The canonical SMILES for 1-ethenoxy-4-(2-methoxyethyl)benzene is C=COc1ccc(CCOC)cc1.
What is the InChIKey of 1-ethenoxy-4-(2-methoxyethyl)benzene?
The InChIKey is NYRYTXRKAILFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-3-13-11-6-4-10(5-7-11)8-9-12-2/h3-7H,1,8-9H2,2H3.
What are the key properties of 1-ethenoxy-4-(2-methoxyethyl)benzene?
1-ethenoxy-4-(2-methoxyethyl)benzene has a molecular weight of 178.23 g/mol, XLogP of 2.40, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenoxy-4-(2-methoxyethyl)benzene is sourced from PubChem (CID 66366359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).