cyclopropane;ethane;2-ethyl-5-methylfuran

C14H28O — CID 142234007

IUPACcyclopropane;ethane;2-ethyl-5-methylfuran
SMILESC1CC1.CC.CC.CCc1ccc(C)o1
InChIInChI=1S/C7H10O.C3H6.2C2H6/c1-3-7-5-4-6(2)8-7;1-2-3-1;2*1-2/h4-5H,3H2,1-2H3;1-3H2;2*1-2H3
InChIKeyZMUKNOMVMJBXFW-UHFFFAOYSA-N
MW212.38 g/mol
LogP5.37
Rot. Bonds1

About cyclopropane;ethane;2-ethyl-5-methylfuran

cyclopropane;ethane;2-ethyl-5-methylfuran (PubChem CID 142234007) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is cyclopropane;ethane;2-ethyl-5-methylfuran.

Molecular Properties

Compound Namecyclopropane;ethane;2-ethyl-5-methylfuran
PubChem CID142234007
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Namecyclopropane;ethane;2-ethyl-5-methylfuran
SMILESC1CC1.CC.CC.CCc1ccc(C)o1
InChIInChI=1S/C7H10O.C3H6.2C2H6/c1-3-7-5-4-6(2)8-7;1-2-3-1;2*1-2/h4-5H,3H2,1-2H3;1-3H2;2*1-2H3
InChIKeyZMUKNOMVMJBXFW-UHFFFAOYSA-N
XLogP5.37
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.38
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopropane;ethane;2-ethyl-5-methylfuran?
The IUPAC name of cyclopropane;ethane;2-ethyl-5-methylfuran (CID 142234007) is cyclopropane;ethane;2-ethyl-5-methylfuran.
What is the SMILES notation for cyclopropane;ethane;2-ethyl-5-methylfuran?
The canonical SMILES for cyclopropane;ethane;2-ethyl-5-methylfuran is C1CC1.CC.CC.CCc1ccc(C)o1.
What is the InChIKey of cyclopropane;ethane;2-ethyl-5-methylfuran?
The InChIKey is ZMUKNOMVMJBXFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O.C3H6.2C2H6/c1-3-7-5-4-6(2)8-7;1-2-3-1;2*1-2/h4-5H,3H2,1-2H3;1-3H2;2*1-2H3.
What are the key properties of cyclopropane;ethane;2-ethyl-5-methylfuran?
cyclopropane;ethane;2-ethyl-5-methylfuran has a molecular weight of 212.38 g/mol, XLogP of 5.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropane;ethane;2-ethyl-5-methylfuran is sourced from PubChem (CID 142234007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).