1,1-diethyl-2-methyl-3-propylcyclopropane

C11H22 — CID 140701623

IUPAC1,1-diethyl-2-methyl-3-propylcyclopropane
SMILESCCCC1C(C)C1(CC)CC
InChIInChI=1S/C11H22/c1-5-8-10-9(4)11(10,6-2)7-3/h9-10H,5-8H2,1-4H3
InChIKeyISIWAGIDVPFLIB-UHFFFAOYSA-N
MW154.30 g/mol
LogP3.86
Rot. Bonds4

About 1,1-diethyl-2-methyl-3-propylcyclopropane

1,1-diethyl-2-methyl-3-propylcyclopropane (PubChem CID 140701623) has the molecular formula C11H22 and a molecular weight of 154.30 g/mol. Its IUPAC name is 1,1-diethyl-2-methyl-3-propylcyclopropane.

Molecular Properties

Compound Name1,1-diethyl-2-methyl-3-propylcyclopropane
PubChem CID140701623
Molecular FormulaC11H22
Molecular Weight154.30 g/mol
Exact Mass154.17
IUPAC Name1,1-diethyl-2-methyl-3-propylcyclopropane
SMILESCCCC1C(C)C1(CC)CC
InChIInChI=1S/C11H22/c1-5-8-10-9(4)11(10,6-2)7-3/h9-10H,5-8H2,1-4H3
InChIKeyISIWAGIDVPFLIB-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.30
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1-diethyl-2-methyl-3-propylcyclopropane?
The IUPAC name of 1,1-diethyl-2-methyl-3-propylcyclopropane (CID 140701623) is 1,1-diethyl-2-methyl-3-propylcyclopropane.
What is the SMILES notation for 1,1-diethyl-2-methyl-3-propylcyclopropane?
The canonical SMILES for 1,1-diethyl-2-methyl-3-propylcyclopropane is CCCC1C(C)C1(CC)CC.
What is the InChIKey of 1,1-diethyl-2-methyl-3-propylcyclopropane?
The InChIKey is ISIWAGIDVPFLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22/c1-5-8-10-9(4)11(10,6-2)7-3/h9-10H,5-8H2,1-4H3.
What are the key properties of 1,1-diethyl-2-methyl-3-propylcyclopropane?
1,1-diethyl-2-methyl-3-propylcyclopropane has a molecular weight of 154.30 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethyl-2-methyl-3-propylcyclopropane is sourced from PubChem (CID 140701623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).