1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane

C11H18 — CID 123269822

IUPAC1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane
SMILESCC=C=CCC1C(C)C1CC
InChIInChI=1S/C11H18/c1-4-6-7-8-11-9(3)10(11)5-2/h4,7,9-11H,5,8H2,1-3H3
InChIKeyKLZADDGLFWVLRK-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.40
Rot. Bonds3

About 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane

1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane (PubChem CID 123269822) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane.

Molecular Properties

Compound Name1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane
PubChem CID123269822
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane
SMILESCC=C=CCC1C(C)C1CC
InChIInChI=1S/C11H18/c1-4-6-7-8-11-9(3)10(11)5-2/h4,7,9-11H,5,8H2,1-3H3
InChIKeyKLZADDGLFWVLRK-UHFFFAOYSA-N
XLogP3.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane?
The IUPAC name of 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane (CID 123269822) is 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane.
What is the SMILES notation for 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane?
The canonical SMILES for 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane is CC=C=CCC1C(C)C1CC.
What is the InChIKey of 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane?
The InChIKey is KLZADDGLFWVLRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18/c1-4-6-7-8-11-9(3)10(11)5-2/h4,7,9-11H,5,8H2,1-3H3.
What are the key properties of 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane?
1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane has a molecular weight of 150.26 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-methyl-3-penta-2,3-dienylcyclopropane is sourced from PubChem (CID 123269822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).