1-(cyclopenten-1-yl)cyclooctene

C13H20 — CID 91463872

IUPAC1-(cyclopenten-1-yl)cyclooctene
SMILESC1=C(C2=CCCCCCC2)CCC1
InChIInChI=1S/C13H20/c1-2-4-8-12(9-5-3-1)13-10-6-7-11-13/h8,10H,1-7,9,11H2
InChIKeyPAPWNXDQCQDEJG-UHFFFAOYSA-N
MW176.30 g/mol
LogP4.38
Rot. Bonds1

About 1-(cyclopenten-1-yl)cyclooctene

1-(cyclopenten-1-yl)cyclooctene (PubChem CID 91463872) has the molecular formula C13H20 and a molecular weight of 176.30 g/mol. Its IUPAC name is 1-(cyclopenten-1-yl)cyclooctene.

Molecular Properties

Compound Name1-(cyclopenten-1-yl)cyclooctene
PubChem CID91463872
Molecular FormulaC13H20
Molecular Weight176.30 g/mol
Exact Mass176.16
IUPAC Name1-(cyclopenten-1-yl)cyclooctene
SMILESC1=C(C2=CCCCCCC2)CCC1
InChIInChI=1S/C13H20/c1-2-4-8-12(9-5-3-1)13-10-6-7-11-13/h8,10H,1-7,9,11H2
InChIKeyPAPWNXDQCQDEJG-UHFFFAOYSA-N
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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1-(cyclohepten-1-yl)cycloheptene;trichloro(ethyl)silane
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8-[(1E)-cycloocten-1-yl]-2,3,4,5,6,7-hexahydroazocine
CID 67389294
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CID 66646162
3,4,6,7,8,9-hexahydro-2H-cyclohepta[b]pyridine
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(3Z)-2-(cyclononen-1-yl)cyclonona-1,3-diene
CID 173204255
1-(4-phenylphenyl)cycloheptene
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2-(cyclohexen-1-yl)cyclohex-2-en-1-one
CID 122375169
6-(cycloocten-1-yl)-2,3,4,5-tetrahydrooxocin-8-one
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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenten-1-yl)cyclooctene?
The IUPAC name of 1-(cyclopenten-1-yl)cyclooctene (CID 91463872) is 1-(cyclopenten-1-yl)cyclooctene.
What is the SMILES notation for 1-(cyclopenten-1-yl)cyclooctene?
The canonical SMILES for 1-(cyclopenten-1-yl)cyclooctene is C1=C(C2=CCCCCCC2)CCC1.
What is the InChIKey of 1-(cyclopenten-1-yl)cyclooctene?
The InChIKey is PAPWNXDQCQDEJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20/c1-2-4-8-12(9-5-3-1)13-10-6-7-11-13/h8,10H,1-7,9,11H2.
What are the key properties of 1-(cyclopenten-1-yl)cyclooctene?
1-(cyclopenten-1-yl)cyclooctene has a molecular weight of 176.30 g/mol, XLogP of 4.38, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenten-1-yl)cyclooctene is sourced from PubChem (CID 91463872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).