1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene

C11H12 — CID 11062509

IUPAC1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene
SMILESC1=CCC(CC2=CC=CC2)=C1
InChIInChI=1S/C11H12/c1-2-6-10(5-1)9-11-7-3-4-8-11/h1-5,7H,6,8-9H2
InChIKeyMNZVDLKGKIWKLM-UHFFFAOYSA-N
MW144.22 g/mol
LogP3.15
Rot. Bonds2

About 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene

1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene (PubChem CID 11062509) has the molecular formula C11H12 and a molecular weight of 144.22 g/mol. Its IUPAC name is 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene
PubChem CID11062509
Molecular FormulaC11H12
Molecular Weight144.22 g/mol
Exact Mass144.09
IUPAC Name1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene
SMILESC1=CCC(CC2=CC=CC2)=C1
InChIInChI=1S/C11H12/c1-2-6-10(5-1)9-11-7-3-4-8-11/h1-5,7H,6,8-9H2
InChIKeyMNZVDLKGKIWKLM-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene?
The IUPAC name of 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene (CID 11062509) is 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene.
What is the SMILES notation for 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene?
The canonical SMILES for 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene is C1=CCC(CC2=CC=CC2)=C1.
What is the InChIKey of 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene?
The InChIKey is MNZVDLKGKIWKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12/c1-2-6-10(5-1)9-11-7-3-4-8-11/h1-5,7H,6,8-9H2.
What are the key properties of 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene?
1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene has a molecular weight of 144.22 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenta-1,3-dien-1-ylmethyl)cyclopenta-1,3-diene is sourced from PubChem (CID 11062509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).