ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene

C18H24 — CID 145481812

IUPACethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene
SMILESC=C.CC.CCC1C2=CCC=C2c2ccccc21
InChIInChI=1S/C14H14.C2H6.C2H4/c1-2-10-11-6-3-4-7-13(11)14-9-5-8-12(10)14;2*1-2/h3-4,6-10H,2,5H2,1H3;1-2H3;1-2H2
InChIKeyXYUVDKABHJRSDI-UHFFFAOYSA-N
MW240.39 g/mol
LogP5.74
Rot. Bonds1

About ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene

ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene (PubChem CID 145481812) has the molecular formula C18H24 and a molecular weight of 240.39 g/mol. Its IUPAC name is ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene.

Molecular Properties

Compound Nameethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene
PubChem CID145481812
Molecular FormulaC18H24
Molecular Weight240.39 g/mol
Exact Mass240.19
IUPAC Nameethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene
SMILESC=C.CC.CCC1C2=CCC=C2c2ccccc21
InChIInChI=1S/C14H14.C2H6.C2H4/c1-2-10-11-6-3-4-7-13(11)14-9-5-8-12(10)14;2*1-2/h3-4,6-10H,2,5H2,1H3;1-2H3;1-2H2
InChIKeyXYUVDKABHJRSDI-UHFFFAOYSA-N
XLogP5.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.39
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene?
The IUPAC name of ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene (CID 145481812) is ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene.
What is the SMILES notation for ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene?
The canonical SMILES for ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene is C=C.CC.CCC1C2=CCC=C2c2ccccc21.
What is the InChIKey of ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene?
The InChIKey is XYUVDKABHJRSDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14.C2H6.C2H4/c1-2-10-11-6-3-4-7-13(11)14-9-5-8-12(10)14;2*1-2/h3-4,6-10H,2,5H2,1H3;1-2H3;1-2H2.
What are the key properties of ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene?
ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene has a molecular weight of 240.39 g/mol, XLogP of 5.74, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene;4-ethyl-2,4-dihydrocyclopenta[a]indene is sourced from PubChem (CID 145481812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).