ethane;1-methyl-2-propylcyclopropane

C11H26 — CID 144710386

IUPACethane;1-methyl-2-propylcyclopropane
SMILESCC.CC.CCCC1CC1C
InChIInChI=1S/C7H14.2C2H6/c1-3-4-7-5-6(7)2;2*1-2/h6-7H,3-5H2,1-2H3;2*1-2H3
InChIKeyLRAYJBSVXRUXAE-UHFFFAOYSA-N
MW158.33 g/mol
LogP4.49
Rot. Bonds2

About ethane;1-methyl-2-propylcyclopropane

ethane;1-methyl-2-propylcyclopropane (PubChem CID 144710386) has the molecular formula C11H26 and a molecular weight of 158.33 g/mol. Its IUPAC name is ethane;1-methyl-2-propylcyclopropane.

Molecular Properties

Compound Nameethane;1-methyl-2-propylcyclopropane
PubChem CID144710386
Molecular FormulaC11H26
Molecular Weight158.33 g/mol
Exact Mass158.20
IUPAC Nameethane;1-methyl-2-propylcyclopropane
SMILESCC.CC.CCCC1CC1C
InChIInChI=1S/C7H14.2C2H6/c1-3-4-7-5-6(7)2;2*1-2/h6-7H,3-5H2,1-2H3;2*1-2H3
InChIKeyLRAYJBSVXRUXAE-UHFFFAOYSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.33
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-2-propylcyclopropane?
The IUPAC name of ethane;1-methyl-2-propylcyclopropane (CID 144710386) is ethane;1-methyl-2-propylcyclopropane.
What is the SMILES notation for ethane;1-methyl-2-propylcyclopropane?
The canonical SMILES for ethane;1-methyl-2-propylcyclopropane is CC.CC.CCCC1CC1C.
What is the InChIKey of ethane;1-methyl-2-propylcyclopropane?
The InChIKey is LRAYJBSVXRUXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14.2C2H6/c1-3-4-7-5-6(7)2;2*1-2/h6-7H,3-5H2,1-2H3;2*1-2H3.
What are the key properties of ethane;1-methyl-2-propylcyclopropane?
ethane;1-methyl-2-propylcyclopropane has a molecular weight of 158.33 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-2-propylcyclopropane is sourced from PubChem (CID 144710386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).