1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane

C14H26 — CID 123748919

IUPAC1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane
SMILESCCCC(C)CC1CC1C1CC1CC
InChIInChI=1S/C14H26/c1-4-6-10(3)7-12-9-14(12)13-8-11(13)5-2/h10-14H,4-9H2,1-3H3
InChIKeyJWIPVVGNQVMKSJ-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.49
Rot. Bonds6

About 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane

1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane (PubChem CID 123748919) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane.

Molecular Properties

Compound Name1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane
PubChem CID123748919
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane
SMILESCCCC(C)CC1CC1C1CC1CC
InChIInChI=1S/C14H26/c1-4-6-10(3)7-12-9-14(12)13-8-11(13)5-2/h10-14H,4-9H2,1-3H3
InChIKeyJWIPVVGNQVMKSJ-UHFFFAOYSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane?
The IUPAC name of 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane (CID 123748919) is 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane.
What is the SMILES notation for 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane?
The canonical SMILES for 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane is CCCC(C)CC1CC1C1CC1CC.
What is the InChIKey of 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane?
The InChIKey is JWIPVVGNQVMKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-4-6-10(3)7-12-9-14(12)13-8-11(13)5-2/h10-14H,4-9H2,1-3H3.
What are the key properties of 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane?
1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane has a molecular weight of 194.36 g/mol, XLogP of 4.49, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[2-(2-methylpentyl)cyclopropyl]cyclopropane is sourced from PubChem (CID 123748919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).