2-(4-propylnaphthalen-1-yl)-1,3-dioxolane

C16H18O2 — CID 59092303

IUPAC2-(4-propylnaphthalen-1-yl)-1,3-dioxolane
SMILESCCCc1ccc(C2OCCO2)c2ccccc12
InChIInChI=1S/C16H18O2/c1-2-5-12-8-9-15(16-17-10-11-18-16)14-7-4-3-6-13(12)14/h3-4,6-9,16H,2,5,10-11H2,1H3
InChIKeyZTDIPAKDLQTCGV-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.84
Rot. Bonds3

About 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane

2-(4-propylnaphthalen-1-yl)-1,3-dioxolane (PubChem CID 59092303) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane.

Molecular Properties

Compound Name2-(4-propylnaphthalen-1-yl)-1,3-dioxolane
PubChem CID59092303
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name2-(4-propylnaphthalen-1-yl)-1,3-dioxolane
SMILESCCCc1ccc(C2OCCO2)c2ccccc12
InChIInChI=1S/C16H18O2/c1-2-5-12-8-9-15(16-17-10-11-18-16)14-7-4-3-6-13(12)14/h3-4,6-9,16H,2,5,10-11H2,1H3
InChIKeyZTDIPAKDLQTCGV-UHFFFAOYSA-N
XLogP3.84
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane?
The IUPAC name of 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane (CID 59092303) is 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane.
What is the SMILES notation for 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane?
The canonical SMILES for 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane is CCCc1ccc(C2OCCO2)c2ccccc12.
What is the InChIKey of 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane?
The InChIKey is ZTDIPAKDLQTCGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-2-5-12-8-9-15(16-17-10-11-18-16)14-7-4-3-6-13(12)14/h3-4,6-9,16H,2,5,10-11H2,1H3.
What are the key properties of 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane?
2-(4-propylnaphthalen-1-yl)-1,3-dioxolane has a molecular weight of 242.32 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propylnaphthalen-1-yl)-1,3-dioxolane is sourced from PubChem (CID 59092303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).