5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene

C14H18 — CID 19033087

IUPAC5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene
SMILESCC1=CC(C)(C2=CC=CC2)C(C)=C1C
InChIInChI=1S/C14H18/c1-10-9-14(4,12(3)11(10)2)13-7-5-6-8-13/h5-7,9H,8H2,1-4H3
InChIKeyCJGJBHWTGGAQEP-UHFFFAOYSA-N
MW186.30 g/mol
LogP4.18
Rot. Bonds1

About 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene

5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene (PubChem CID 19033087) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene.

Molecular Properties

Compound Name5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene
PubChem CID19033087
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Name5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene
SMILESCC1=CC(C)(C2=CC=CC2)C(C)=C1C
InChIInChI=1S/C14H18/c1-10-9-14(4,12(3)11(10)2)13-7-5-6-8-13/h5-7,9H,8H2,1-4H3
InChIKeyCJGJBHWTGGAQEP-UHFFFAOYSA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene?
The IUPAC name of 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene (CID 19033087) is 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene.
What is the SMILES notation for 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene?
The canonical SMILES for 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene is CC1=CC(C)(C2=CC=CC2)C(C)=C1C.
What is the InChIKey of 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene?
The InChIKey is CJGJBHWTGGAQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-10-9-14(4,12(3)11(10)2)13-7-5-6-8-13/h5-7,9H,8H2,1-4H3.
What are the key properties of 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene?
5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene has a molecular weight of 186.30 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopenta-1,3-dien-1-yl-1,2,3,5-tetramethylcyclopenta-1,3-diene is sourced from PubChem (CID 19033087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).