2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane

C11H18 — CID 90916489

IUPAC2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane
SMILESCCCC1C2(C)C3(C)C(C)C132
InChIInChI=1S/C11H18/c1-5-6-8-10(4)9(3)7(2)11(8,9)10/h7-8H,5-6H2,1-4H3
InChIKeyYVVVTUCRBUTPGK-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.08
Rot. Bonds2

About 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane

2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane (PubChem CID 90916489) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane.

Molecular Properties

Compound Name2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane
PubChem CID90916489
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane
SMILESCCCC1C2(C)C3(C)C(C)C132
InChIInChI=1S/C11H18/c1-5-6-8-10(4)9(3)7(2)11(8,9)10/h7-8H,5-6H2,1-4H3
InChIKeyYVVVTUCRBUTPGK-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane?
The IUPAC name of 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane (CID 90916489) is 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane.
What is the SMILES notation for 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane?
The canonical SMILES for 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane is CCCC1C2(C)C3(C)C(C)C132.
What is the InChIKey of 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane?
The InChIKey is YVVVTUCRBUTPGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-5-6-8-10(4)9(3)7(2)11(8,9)10/h7-8H,5-6H2,1-4H3.
What are the key properties of 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane?
2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane has a molecular weight of 150.26 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-5-propyltricyclo[2.1.0.01,3]pentane is sourced from PubChem (CID 90916489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).