7-ethenoxy-1-prop-2-enoxynaphthalene

C15H14O2 — CID 164732321

IUPAC7-ethenoxy-1-prop-2-enoxynaphthalene
SMILESC=CCOc1cccc2ccc(OC=C)cc12
InChIInChI=1S/C15H14O2/c1-3-10-17-15-7-5-6-12-8-9-13(16-4-2)11-14(12)15/h3-9,11H,1-2,10H2
InChIKeyPTVRMGIBPBYULW-UHFFFAOYSA-N
MW226.27 g/mol
LogP3.93
Rot. Bonds5

About 7-ethenoxy-1-prop-2-enoxynaphthalene

7-ethenoxy-1-prop-2-enoxynaphthalene (PubChem CID 164732321) has the molecular formula C15H14O2 and a molecular weight of 226.27 g/mol. Its IUPAC name is 7-ethenoxy-1-prop-2-enoxynaphthalene.

Molecular Properties

Compound Name7-ethenoxy-1-prop-2-enoxynaphthalene
PubChem CID164732321
Molecular FormulaC15H14O2
Molecular Weight226.27 g/mol
Exact Mass226.10
IUPAC Name7-ethenoxy-1-prop-2-enoxynaphthalene
SMILESC=CCOc1cccc2ccc(OC=C)cc12
InChIInChI=1S/C15H14O2/c1-3-10-17-15-7-5-6-12-8-9-13(16-4-2)11-14(12)15/h3-9,11H,1-2,10H2
InChIKeyPTVRMGIBPBYULW-UHFFFAOYSA-N
XLogP3.93
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-ethenoxy-1-prop-2-enoxynaphthalene?
The IUPAC name of 7-ethenoxy-1-prop-2-enoxynaphthalene (CID 164732321) is 7-ethenoxy-1-prop-2-enoxynaphthalene.
What is the SMILES notation for 7-ethenoxy-1-prop-2-enoxynaphthalene?
The canonical SMILES for 7-ethenoxy-1-prop-2-enoxynaphthalene is C=CCOc1cccc2ccc(OC=C)cc12.
What is the InChIKey of 7-ethenoxy-1-prop-2-enoxynaphthalene?
The InChIKey is PTVRMGIBPBYULW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-3-10-17-15-7-5-6-12-8-9-13(16-4-2)11-14(12)15/h3-9,11H,1-2,10H2.
What are the key properties of 7-ethenoxy-1-prop-2-enoxynaphthalene?
7-ethenoxy-1-prop-2-enoxynaphthalene has a molecular weight of 226.27 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenoxy-1-prop-2-enoxynaphthalene is sourced from PubChem (CID 164732321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).