1-ethyl-1-propoxycyclopropane

C8H16O — CID 59107418

IUPAC1-ethyl-1-propoxycyclopropane
SMILESCCCOC1(CC)CC1
InChIInChI=1S/C8H16O/c1-3-7-9-8(4-2)5-6-8/h3-7H2,1-2H3
InChIKeyABOWQXPZSMTKJH-UHFFFAOYSA-N
MW128.22 g/mol
LogP2.36
Rot. Bonds4

About 1-ethyl-1-propoxycyclopropane

1-ethyl-1-propoxycyclopropane (PubChem CID 59107418) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-ethyl-1-propoxycyclopropane.

Molecular Properties

Compound Name1-ethyl-1-propoxycyclopropane
PubChem CID59107418
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name1-ethyl-1-propoxycyclopropane
SMILESCCCOC1(CC)CC1
InChIInChI=1S/C8H16O/c1-3-7-9-8(4-2)5-6-8/h3-7H2,1-2H3
InChIKeyABOWQXPZSMTKJH-UHFFFAOYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-ethyl-1-propoxycyclopropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-propoxycyclopropane?
The IUPAC name of 1-ethyl-1-propoxycyclopropane (CID 59107418) is 1-ethyl-1-propoxycyclopropane.
What is the SMILES notation for 1-ethyl-1-propoxycyclopropane?
The canonical SMILES for 1-ethyl-1-propoxycyclopropane is CCCOC1(CC)CC1.
What is the InChIKey of 1-ethyl-1-propoxycyclopropane?
The InChIKey is ABOWQXPZSMTKJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-3-7-9-8(4-2)5-6-8/h3-7H2,1-2H3.
What are the key properties of 1-ethyl-1-propoxycyclopropane?
1-ethyl-1-propoxycyclopropane has a molecular weight of 128.22 g/mol, XLogP of 2.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-propoxycyclopropane is sourced from PubChem (CID 59107418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).