1,2,3,4,5-pentaethylcyclopenta-1,3-diene

C15H26 — CID 11986700

IUPAC1,2,3,4,5-pentaethylcyclopenta-1,3-diene
SMILESCCC1=C(CC)C(CC)C(CC)=C1CC
InChIInChI=1S/C15H26/c1-6-11-12(7-2)14(9-4)15(10-5)13(11)8-3/h11H,6-10H2,1-5H3
InChIKeyAGWRAAIQXVWVLJ-UHFFFAOYSA-N
MW206.37 g/mol
LogP5.26
Rot. Bonds5

About 1,2,3,4,5-pentaethylcyclopenta-1,3-diene

1,2,3,4,5-pentaethylcyclopenta-1,3-diene (PubChem CID 11986700) has the molecular formula C15H26 and a molecular weight of 206.37 g/mol. Its IUPAC name is 1,2,3,4,5-pentaethylcyclopenta-1,3-diene.

Molecular Properties

Compound Name1,2,3,4,5-pentaethylcyclopenta-1,3-diene
PubChem CID11986700
Molecular FormulaC15H26
Molecular Weight206.37 g/mol
Exact Mass206.20
IUPAC Name1,2,3,4,5-pentaethylcyclopenta-1,3-diene
SMILESCCC1=C(CC)C(CC)C(CC)=C1CC
InChIInChI=1S/C15H26/c1-6-11-12(7-2)14(9-4)15(10-5)13(11)8-3/h11H,6-10H2,1-5H3
InChIKeyAGWRAAIQXVWVLJ-UHFFFAOYSA-N
XLogP5.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500206.37
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5-pentaethylcyclopenta-1,3-diene?
The IUPAC name of 1,2,3,4,5-pentaethylcyclopenta-1,3-diene (CID 11986700) is 1,2,3,4,5-pentaethylcyclopenta-1,3-diene.
What is the SMILES notation for 1,2,3,4,5-pentaethylcyclopenta-1,3-diene?
The canonical SMILES for 1,2,3,4,5-pentaethylcyclopenta-1,3-diene is CCC1=C(CC)C(CC)C(CC)=C1CC.
What is the InChIKey of 1,2,3,4,5-pentaethylcyclopenta-1,3-diene?
The InChIKey is AGWRAAIQXVWVLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26/c1-6-11-12(7-2)14(9-4)15(10-5)13(11)8-3/h11H,6-10H2,1-5H3.
What are the key properties of 1,2,3,4,5-pentaethylcyclopenta-1,3-diene?
1,2,3,4,5-pentaethylcyclopenta-1,3-diene has a molecular weight of 206.37 g/mol, XLogP of 5.26, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5-pentaethylcyclopenta-1,3-diene is sourced from PubChem (CID 11986700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).