1-ethenyl-5-(2-ethoxyethoxy)naphthalene

C16H18O2 — CID 68829960

IUPAC1-ethenyl-5-(2-ethoxyethoxy)naphthalene
SMILESC=Cc1cccc2c(OCCOCC)cccc12
InChIInChI=1S/C16H18O2/c1-3-13-7-5-9-15-14(13)8-6-10-16(15)18-12-11-17-4-2/h3,5-10H,1,4,11-12H2,2H3
InChIKeyFYNGHIYYRXESDG-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.90
Rot. Bonds6

About 1-ethenyl-5-(2-ethoxyethoxy)naphthalene

1-ethenyl-5-(2-ethoxyethoxy)naphthalene (PubChem CID 68829960) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-ethenyl-5-(2-ethoxyethoxy)naphthalene.

Molecular Properties

Compound Name1-ethenyl-5-(2-ethoxyethoxy)naphthalene
PubChem CID68829960
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name1-ethenyl-5-(2-ethoxyethoxy)naphthalene
SMILESC=Cc1cccc2c(OCCOCC)cccc12
InChIInChI=1S/C16H18O2/c1-3-13-7-5-9-15-14(13)8-6-10-16(15)18-12-11-17-4-2/h3,5-10H,1,4,11-12H2,2H3
InChIKeyFYNGHIYYRXESDG-UHFFFAOYSA-N
XLogP3.90
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[5-(2-ethoxyethoxy)naphthalen-1-yl]oxyethoxy]ethanol
CID 144738763
1-ethenyl-2-ethoxy-3-methoxybenzene
CID 11629687
1-chloro-4-(2-ethoxyethoxy)naphthalene
CID 112769647
3-ethoxy-2-(3-ethoxypropoxy)benzaldehyde
CID 65175736
5-(2-ethoxyethoxy)-2-(2-ethoxyethyl)isoquinolin-1-one
CID 43985622
1-(2-ethoxyethoxy)-2-methoxybenzene
CID 57249631
1-ethenyl-2-heptadecoxybenzene
CID 139672731
2-chloro-1-ethenyl-3-ethoxybenzene
CID 19358720
2-bromo-1-ethenyl-3-(2-methoxyethoxy)benzene
CID 118268661
1-ethenylnaphthalene;propane
CID 90732485
1-ethenyl-3-ethoxy-2-phenoxybenzene;2-ethenylphenol
CID 22385455
1-[2-[2-(4-ethoxyphenoxy)ethoxy]ethoxy]naphthalene
CID 2283150

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-5-(2-ethoxyethoxy)naphthalene?
The IUPAC name of 1-ethenyl-5-(2-ethoxyethoxy)naphthalene (CID 68829960) is 1-ethenyl-5-(2-ethoxyethoxy)naphthalene.
What is the SMILES notation for 1-ethenyl-5-(2-ethoxyethoxy)naphthalene?
The canonical SMILES for 1-ethenyl-5-(2-ethoxyethoxy)naphthalene is C=Cc1cccc2c(OCCOCC)cccc12.
What is the InChIKey of 1-ethenyl-5-(2-ethoxyethoxy)naphthalene?
The InChIKey is FYNGHIYYRXESDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-3-13-7-5-9-15-14(13)8-6-10-16(15)18-12-11-17-4-2/h3,5-10H,1,4,11-12H2,2H3.
What are the key properties of 1-ethenyl-5-(2-ethoxyethoxy)naphthalene?
1-ethenyl-5-(2-ethoxyethoxy)naphthalene has a molecular weight of 242.32 g/mol, XLogP of 3.90, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-5-(2-ethoxyethoxy)naphthalene is sourced from PubChem (CID 68829960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).