cyclopropane;ethoxyethane

C7H16O — CID 66628598

IUPACcyclopropane;ethoxyethane
SMILESC1CC1.CCOCC
InChIInChI=1S/C4H10O.C3H6/c1-3-5-4-2;1-2-3-1/h3-4H2,1-2H3;1-3H2
InChIKeyFCCVWTHCEINTSA-UHFFFAOYSA-N
MW116.20 g/mol
LogP2.21
Rot. Bonds2

About cyclopropane;ethoxyethane

cyclopropane;ethoxyethane (PubChem CID 66628598) has the molecular formula C7H16O and a molecular weight of 116.20 g/mol. Its IUPAC name is cyclopropane;ethoxyethane.

Molecular Properties

Compound Namecyclopropane;ethoxyethane
PubChem CID66628598
Molecular FormulaC7H16O
Molecular Weight116.20 g/mol
Exact Mass116.12
IUPAC Namecyclopropane;ethoxyethane
SMILESC1CC1.CCOCC
InChIInChI=1S/C4H10O.C3H6/c1-3-5-4-2;1-2-3-1/h3-4H2,1-2H3;1-3H2
InChIKeyFCCVWTHCEINTSA-UHFFFAOYSA-N
XLogP2.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.20
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopropane;ethoxyethane?
The IUPAC name of cyclopropane;ethoxyethane (CID 66628598) is cyclopropane;ethoxyethane.
What is the SMILES notation for cyclopropane;ethoxyethane?
The canonical SMILES for cyclopropane;ethoxyethane is C1CC1.CCOCC.
What is the InChIKey of cyclopropane;ethoxyethane?
The InChIKey is FCCVWTHCEINTSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C3H6/c1-3-5-4-2;1-2-3-1/h3-4H2,1-2H3;1-3H2.
What are the key properties of cyclopropane;ethoxyethane?
cyclopropane;ethoxyethane has a molecular weight of 116.20 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;ethoxyethane is sourced from PubChem (CID 66628598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).