cyclopropane;ethane

C15H42 — CID 144519947

IUPACcyclopropane;ethane
SMILESC1CC1.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C3H6.6C2H6/c1-2-3-1;6*1-2/h1-3H2;6*1-2H3
InChIKeyMCQQOBPLBUHTMM-UHFFFAOYSA-N
MW222.50 g/mol
LogP7.33
Rot. Bonds

About cyclopropane;ethane

cyclopropane;ethane (PubChem CID 144519947) has the molecular formula C15H42 and a molecular weight of 222.50 g/mol. Its IUPAC name is cyclopropane;ethane.

Molecular Properties

Compound Namecyclopropane;ethane
PubChem CID144519947
Molecular FormulaC15H42
Molecular Weight222.50 g/mol
Exact Mass222.33
IUPAC Namecyclopropane;ethane
SMILESC1CC1.CC.CC.CC.CC.CC.CC
InChIInChI=1S/C3H6.6C2H6/c1-2-3-1;6*1-2/h1-3H2;6*1-2H3
InChIKeyMCQQOBPLBUHTMM-UHFFFAOYSA-N
XLogP7.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.50
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cyclopropane;ethane?
The IUPAC name of cyclopropane;ethane (CID 144519947) is cyclopropane;ethane.
What is the SMILES notation for cyclopropane;ethane?
The canonical SMILES for cyclopropane;ethane is C1CC1.CC.CC.CC.CC.CC.CC.
What is the InChIKey of cyclopropane;ethane?
The InChIKey is MCQQOBPLBUHTMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6.6C2H6/c1-2-3-1;6*1-2/h1-3H2;6*1-2H3.
What are the key properties of cyclopropane;ethane?
cyclopropane;ethane has a molecular weight of 222.50 g/mol, XLogP of 7.33, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;ethane is sourced from PubChem (CID 144519947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).