2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene

C19H20O — CID 174804005

IUPAC2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene
SMILESC=CCOc1ccc2c(CC=C)cccc2c1CC=C
InChIInChI=1S/C19H20O/c1-4-8-15-10-7-11-17-16(15)12-13-19(20-14-6-3)18(17)9-5-2/h4-7,10-13H,1-3,8-9,14H2
InChIKeyCBGYYKJQMXXNIT-UHFFFAOYSA-N
MW264.37 g/mol
LogP4.86
Rot. Bonds7

About 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene

2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene (PubChem CID 174804005) has the molecular formula C19H20O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene.

Molecular Properties

Compound Name2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene
PubChem CID174804005
Molecular FormulaC19H20O
Molecular Weight264.37 g/mol
Exact Mass264.15
IUPAC Name2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene
SMILESC=CCOc1ccc2c(CC=C)cccc2c1CC=C
InChIInChI=1S/C19H20O/c1-4-8-15-10-7-11-17-16(15)12-13-19(20-14-6-3)18(17)9-5-2/h4-7,10-13H,1-3,8-9,14H2
InChIKeyCBGYYKJQMXXNIT-UHFFFAOYSA-N
XLogP4.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene?
The IUPAC name of 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene (CID 174804005) is 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene.
What is the SMILES notation for 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene?
The canonical SMILES for 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene is C=CCOc1ccc2c(CC=C)cccc2c1CC=C.
What is the InChIKey of 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene?
The InChIKey is CBGYYKJQMXXNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O/c1-4-8-15-10-7-11-17-16(15)12-13-19(20-14-6-3)18(17)9-5-2/h4-7,10-13H,1-3,8-9,14H2.
What are the key properties of 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene?
2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene has a molecular weight of 264.37 g/mol, XLogP of 4.86, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enoxy-1,5-bis(prop-2-enyl)naphthalene is sourced from PubChem (CID 174804005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).