1-(2,5-diethyldecyl)-2-propylcyclopropane

C20H40 — CID 90691022

IUPAC1-(2,5-diethyldecyl)-2-propylcyclopropane
SMILESCCCCCC(CC)CCC(CC)CC1CC1CCC
InChIInChI=1S/C20H40/c1-5-9-10-12-17(7-3)13-14-18(8-4)15-20-16-19(20)11-6-2/h17-20H,5-16H2,1-4H3
InChIKeyQWCZTCYFVOXJCV-UHFFFAOYSA-N
MW280.54 g/mol
LogP7.23
Rot. Bonds13

About 1-(2,5-diethyldecyl)-2-propylcyclopropane

1-(2,5-diethyldecyl)-2-propylcyclopropane (PubChem CID 90691022) has the molecular formula C20H40 and a molecular weight of 280.54 g/mol. Its IUPAC name is 1-(2,5-diethyldecyl)-2-propylcyclopropane.

Molecular Properties

Compound Name1-(2,5-diethyldecyl)-2-propylcyclopropane
PubChem CID90691022
Molecular FormulaC20H40
Molecular Weight280.54 g/mol
Exact Mass280.31
IUPAC Name1-(2,5-diethyldecyl)-2-propylcyclopropane
SMILESCCCCCC(CC)CCC(CC)CC1CC1CCC
InChIInChI=1S/C20H40/c1-5-9-10-12-17(7-3)13-14-18(8-4)15-20-16-19(20)11-6-2/h17-20H,5-16H2,1-4H3
InChIKeyQWCZTCYFVOXJCV-UHFFFAOYSA-N
XLogP7.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.54
LogP ≤ 57.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3,6-diethylundecane
CID 22051817
1-butyl-2-(6-ethyl-2-methyloctyl)cyclopropane
CID 123426508
12-ethylhentriacontane
CID 91805956
15-ethyltetratriacontane
CID 23358557
7-ethyltetracosane
CID 22223872
7-ethyltetradecane
CID 529902
1-propyl-2-undecylcyclopropane
CID 123636027
1-(2-ethyloctyl)-2-undecan-2-ylcyclohexane
CID 123242548
7-ethyltridecane;methane
CID 158982306
1-(2-methylbutyl)-2-propylcyclopropane
CID 90912055
1-(2-chlorononyl)-2-hexylcyclopropane
CID 70489561
8-(3-ethylhexyl)hexadecane
CID 123944120

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-diethyldecyl)-2-propylcyclopropane?
The IUPAC name of 1-(2,5-diethyldecyl)-2-propylcyclopropane (CID 90691022) is 1-(2,5-diethyldecyl)-2-propylcyclopropane.
What is the SMILES notation for 1-(2,5-diethyldecyl)-2-propylcyclopropane?
The canonical SMILES for 1-(2,5-diethyldecyl)-2-propylcyclopropane is CCCCCC(CC)CCC(CC)CC1CC1CCC.
What is the InChIKey of 1-(2,5-diethyldecyl)-2-propylcyclopropane?
The InChIKey is QWCZTCYFVOXJCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40/c1-5-9-10-12-17(7-3)13-14-18(8-4)15-20-16-19(20)11-6-2/h17-20H,5-16H2,1-4H3.
What are the key properties of 1-(2,5-diethyldecyl)-2-propylcyclopropane?
1-(2,5-diethyldecyl)-2-propylcyclopropane has a molecular weight of 280.54 g/mol, XLogP of 7.23, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-diethyldecyl)-2-propylcyclopropane is sourced from PubChem (CID 90691022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).