tricyclo[5.3.0.01,4]decane

C10H16 — CID 565018

IUPACtricyclo[5.3.0.01,4]decane
SMILESC1CC2CCC3CCC23C1
InChIInChI=1S/C10H16/c1-2-8-3-4-9-5-7-10(8,9)6-1/h8-9H,1-7H2
InChIKeyGTXWEBMMAVTOOJ-UHFFFAOYSA-N
MW136.24 g/mol
LogP2.98
Rot. Bonds

About tricyclo[5.3.0.01,4]decane

tricyclo[5.3.0.01,4]decane (PubChem CID 565018) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is tricyclo[5.3.0.01,4]decane.

Molecular Properties

Compound Nametricyclo[5.3.0.01,4]decane
PubChem CID565018
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Nametricyclo[5.3.0.01,4]decane
SMILESC1CC2CCC3CCC23C1
InChIInChI=1S/C10H16/c1-2-8-3-4-9-5-7-10(8,9)6-1/h8-9H,1-7H2
InChIKeyGTXWEBMMAVTOOJ-UHFFFAOYSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tricyclo[5.3.0.01,4]decane?
The IUPAC name of tricyclo[5.3.0.01,4]decane (CID 565018) is tricyclo[5.3.0.01,4]decane.
What is the SMILES notation for tricyclo[5.3.0.01,4]decane?
The canonical SMILES for tricyclo[5.3.0.01,4]decane is C1CC2CCC3CCC23C1.
What is the InChIKey of tricyclo[5.3.0.01,4]decane?
The InChIKey is GTXWEBMMAVTOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-2-8-3-4-9-5-7-10(8,9)6-1/h8-9H,1-7H2.
What are the key properties of tricyclo[5.3.0.01,4]decane?
tricyclo[5.3.0.01,4]decane has a molecular weight of 136.24 g/mol, XLogP of 2.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[5.3.0.01,4]decane is sourced from PubChem (CID 565018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).