(1E)-1-ethylidene-2-methylidenecyclopentane

C8H12 — CID 142947641

IUPAC(1E)-1-ethylidene-2-methylidenecyclopentane
SMILESC=C1CCC/C1=C\C
InChIInChI=1S/C8H12/c1-3-8-6-4-5-7(8)2/h3H,2,4-6H2,1H3/b8-3+
InChIKeyZMHVFMVQOKCCNT-FPYGCLRLSA-N
MW108.18 g/mol
LogP2.67
Rot. Bonds

About (1E)-1-ethylidene-2-methylidenecyclopentane

(1E)-1-ethylidene-2-methylidenecyclopentane (PubChem CID 142947641) has the molecular formula C8H12 and a molecular weight of 108.18 g/mol. Its IUPAC name is (1E)-1-ethylidene-2-methylidenecyclopentane.

Molecular Properties

Compound Name(1E)-1-ethylidene-2-methylidenecyclopentane
PubChem CID142947641
Molecular FormulaC8H12
Molecular Weight108.18 g/mol
Exact Mass108.09
IUPAC Name(1E)-1-ethylidene-2-methylidenecyclopentane
SMILESC=C1CCC/C1=C\C
InChIInChI=1S/C8H12/c1-3-8-6-4-5-7(8)2/h3H,2,4-6H2,1H3/b8-3+
InChIKeyZMHVFMVQOKCCNT-FPYGCLRLSA-N
XLogP2.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.18
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (1E)-1-ethylidene-2-methylidenecyclopentane?
The IUPAC name of (1E)-1-ethylidene-2-methylidenecyclopentane (CID 142947641) is (1E)-1-ethylidene-2-methylidenecyclopentane.
What is the SMILES notation for (1E)-1-ethylidene-2-methylidenecyclopentane?
The canonical SMILES for (1E)-1-ethylidene-2-methylidenecyclopentane is C=C1CCC/C1=C\C.
What is the InChIKey of (1E)-1-ethylidene-2-methylidenecyclopentane?
The InChIKey is ZMHVFMVQOKCCNT-FPYGCLRLSA-N. The full InChI is InChI=1S/C8H12/c1-3-8-6-4-5-7(8)2/h3H,2,4-6H2,1H3/b8-3+.
What are the key properties of (1E)-1-ethylidene-2-methylidenecyclopentane?
(1E)-1-ethylidene-2-methylidenecyclopentane has a molecular weight of 108.18 g/mol, XLogP of 2.67, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-1-ethylidene-2-methylidenecyclopentane is sourced from PubChem (CID 142947641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).