ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene

C11H18 — CID 143684715

IUPACethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene
SMILESC=C.CC1C=CC(C(C)C)=C1
InChIInChI=1S/C9H14.C2H4/c1-7(2)9-5-4-8(3)6-9;1-2/h4-8H,1-3H3;1-2H2
InChIKeyKPLCVOIMUPPWRI-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.58
Rot. Bonds1

About ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene

ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene (PubChem CID 143684715) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene.

Molecular Properties

Compound Nameethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene
PubChem CID143684715
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Nameethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene
SMILESC=C.CC1C=CC(C(C)C)=C1
InChIInChI=1S/C9H14.C2H4/c1-7(2)9-5-4-8(3)6-9;1-2/h4-8H,1-3H3;1-2H2
InChIKeyKPLCVOIMUPPWRI-UHFFFAOYSA-N
XLogP3.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.58
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 ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene?
The IUPAC name of ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene (CID 143684715) is ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene.
What is the SMILES notation for ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene?
The canonical SMILES for ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene is C=C.CC1C=CC(C(C)C)=C1.
What is the InChIKey of ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene?
The InChIKey is KPLCVOIMUPPWRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14.C2H4/c1-7(2)9-5-4-8(3)6-9;1-2/h4-8H,1-3H3;1-2H2.
What are the key properties of ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene?
ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene has a molecular weight of 150.26 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;5-methyl-2-propan-2-ylcyclopenta-1,3-diene is sourced from PubChem (CID 143684715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).