2-ethyltricyclo[2.1.0.01,3]pentane

C7H10 — CID 20621573

IUPAC2-ethyltricyclo[2.1.0.01,3]pentane
SMILESCCC1C2C3CC132
InChIInChI=1S/C7H10/c1-2-4-6-5-3-7(4,5)6/h4-6H,2-3H2,1H3
InChIKeyIGBUEPZYJOGRTO-UHFFFAOYSA-N
MW94.16 g/mol
LogP1.66
Rot. Bonds1

About 2-ethyltricyclo[2.1.0.01,3]pentane

2-ethyltricyclo[2.1.0.01,3]pentane (PubChem CID 20621573) has the molecular formula C7H10 and a molecular weight of 94.16 g/mol. Its IUPAC name is 2-ethyltricyclo[2.1.0.01,3]pentane.

Molecular Properties

Compound Name2-ethyltricyclo[2.1.0.01,3]pentane
PubChem CID20621573
Molecular FormulaC7H10
Molecular Weight94.16 g/mol
Exact Mass94.08
IUPAC Name2-ethyltricyclo[2.1.0.01,3]pentane
SMILESCCC1C2C3CC132
InChIInChI=1S/C7H10/c1-2-4-6-5-3-7(4,5)6/h4-6H,2-3H2,1H3
InChIKeyIGBUEPZYJOGRTO-UHFFFAOYSA-N
XLogP1.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.16
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-ethyltricyclo[2.1.0.01,3]pentane?
The IUPAC name of 2-ethyltricyclo[2.1.0.01,3]pentane (CID 20621573) is 2-ethyltricyclo[2.1.0.01,3]pentane.
What is the SMILES notation for 2-ethyltricyclo[2.1.0.01,3]pentane?
The canonical SMILES for 2-ethyltricyclo[2.1.0.01,3]pentane is CCC1C2C3CC132.
What is the InChIKey of 2-ethyltricyclo[2.1.0.01,3]pentane?
The InChIKey is IGBUEPZYJOGRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10/c1-2-4-6-5-3-7(4,5)6/h4-6H,2-3H2,1H3.
What are the key properties of 2-ethyltricyclo[2.1.0.01,3]pentane?
2-ethyltricyclo[2.1.0.01,3]pentane has a molecular weight of 94.16 g/mol, XLogP of 1.66, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyltricyclo[2.1.0.01,3]pentane is sourced from PubChem (CID 20621573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).