1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane

C17H34 — CID 123168355

IUPAC1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane
SMILESCCCC(C)CC(CC)CCCCC1CC1C
InChIInChI=1S/C17H34/c1-5-9-14(3)12-16(6-2)10-7-8-11-17-13-15(17)4/h14-17H,5-13H2,1-4H3
InChIKeySNXNJIWUTWFKEE-UHFFFAOYSA-N
MW238.46 g/mol
LogP6.06
Rot. Bonds10

About 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane

1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane (PubChem CID 123168355) has the molecular formula C17H34 and a molecular weight of 238.46 g/mol. Its IUPAC name is 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane
PubChem CID123168355
Molecular FormulaC17H34
Molecular Weight238.46 g/mol
Exact Mass238.27
IUPAC Name1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane
SMILESCCCC(C)CC(CC)CCCCC1CC1C
InChIInChI=1S/C17H34/c1-5-9-14(3)12-16(6-2)10-7-8-11-17-13-15(17)4/h14-17H,5-13H2,1-4H3
InChIKeySNXNJIWUTWFKEE-UHFFFAOYSA-N
XLogP6.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.46
LogP ≤ 56.06
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

Pristane
CID 15979
Squalane
CID 8089
Phytane
CID 12523
Farnesane
CID 19773
Pentylcyclopropane
CID 75640
Isoeicosane
CID 137081
Decylcyclohexane
CID 15713
2-Methylhexadecane
CID 15266
(+-)-2,2,4,4,6,8,8-Heptamethylnonane
CID 20414
2-Methylpentadecane
CID 15267
Cyclohexane, tetradecyl-
CID 15715
6-Propyltridecane
CID 521567

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane?
The IUPAC name of 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane (CID 123168355) is 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane.
What is the SMILES notation for 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane?
The canonical SMILES for 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane is CCCC(C)CC(CC)CCCCC1CC1C.
What is the InChIKey of 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane?
The InChIKey is SNXNJIWUTWFKEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34/c1-5-9-14(3)12-16(6-2)10-7-8-11-17-13-15(17)4/h14-17H,5-13H2,1-4H3.
What are the key properties of 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane?
1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane has a molecular weight of 238.46 g/mol, XLogP of 6.06, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-7-methyldecyl)-2-methylcyclopropane is sourced from PubChem (CID 123168355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).