1-cyclopropyl-2-(2-ethylpentyl)cyclopropane

C13H24 — CID 91372902

IUPAC1-cyclopropyl-2-(2-ethylpentyl)cyclopropane
SMILESCCCC(CC)CC1CC1C1CC1
InChIInChI=1S/C13H24/c1-3-5-10(4-2)8-12-9-13(12)11-6-7-11/h10-13H,3-9H2,1-2H3
InChIKeyMSOHIBQKNFGRSZ-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.25
Rot. Bonds6

About 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane

1-cyclopropyl-2-(2-ethylpentyl)cyclopropane (PubChem CID 91372902) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane.

Molecular Properties

Compound Name1-cyclopropyl-2-(2-ethylpentyl)cyclopropane
PubChem CID91372902
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name1-cyclopropyl-2-(2-ethylpentyl)cyclopropane
SMILESCCCC(CC)CC1CC1C1CC1
InChIInChI=1S/C13H24/c1-3-5-10(4-2)8-12-9-13(12)11-6-7-11/h10-13H,3-9H2,1-2H3
InChIKeyMSOHIBQKNFGRSZ-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane?
The IUPAC name of 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane (CID 91372902) is 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane.
What is the SMILES notation for 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane?
The canonical SMILES for 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane is CCCC(CC)CC1CC1C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane?
The InChIKey is MSOHIBQKNFGRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-3-5-10(4-2)8-12-9-13(12)11-6-7-11/h10-13H,3-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane?
1-cyclopropyl-2-(2-ethylpentyl)cyclopropane has a molecular weight of 180.33 g/mol, XLogP of 4.25, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2-ethylpentyl)cyclopropane is sourced from PubChem (CID 91372902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).