cyclopropane;ethane;propane

C13H32 — CID 143374726

IUPACcyclopropane;ethane;propane
SMILESC1CC1.C1CC1.CC.CC.CCC
InChIInChI=1S/2C3H6.C3H8.2C2H6/c2*1-2-3-1;1-3-2;2*1-2/h2*1-3H2;3H2,1-2H3;2*1-2H3
InChIKeyODKMYQHJLZCGQC-UHFFFAOYSA-N
MW188.40 g/mol
LogP5.81
Rot. Bonds

About cyclopropane;ethane;propane

cyclopropane;ethane;propane (PubChem CID 143374726) has the molecular formula C13H32 and a molecular weight of 188.40 g/mol. Its IUPAC name is cyclopropane;ethane;propane.

Molecular Properties

Compound Namecyclopropane;ethane;propane
PubChem CID143374726
Molecular FormulaC13H32
Molecular Weight188.40 g/mol
Exact Mass188.25
IUPAC Namecyclopropane;ethane;propane
SMILESC1CC1.C1CC1.CC.CC.CCC
InChIInChI=1S/2C3H6.C3H8.2C2H6/c2*1-2-3-1;1-3-2;2*1-2/h2*1-3H2;3H2,1-2H3;2*1-2H3
InChIKeyODKMYQHJLZCGQC-UHFFFAOYSA-N
XLogP5.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500188.40
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cyclopropane;ethane;propane?
The IUPAC name of cyclopropane;ethane;propane (CID 143374726) is cyclopropane;ethane;propane.
What is the SMILES notation for cyclopropane;ethane;propane?
The canonical SMILES for cyclopropane;ethane;propane is C1CC1.C1CC1.CC.CC.CCC.
What is the InChIKey of cyclopropane;ethane;propane?
The InChIKey is ODKMYQHJLZCGQC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H6.C3H8.2C2H6/c2*1-2-3-1;1-3-2;2*1-2/h2*1-3H2;3H2,1-2H3;2*1-2H3.
What are the key properties of cyclopropane;ethane;propane?
cyclopropane;ethane;propane has a molecular weight of 188.40 g/mol, XLogP of 5.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;ethane;propane is sourced from PubChem (CID 143374726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).