1-hexyl-1-methylcyclopropane

C10H20 — CID 524642

IUPAC1-hexyl-1-methylcyclopropane
SMILESCCCCCCC1(C)CC1
InChIInChI=1S/C10H20/c1-3-4-5-6-7-10(2)8-9-10/h3-9H2,1-2H3
InChIKeyMUUNHCADTLHWRS-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.76
Rot. Bonds5

About 1-hexyl-1-methylcyclopropane

1-hexyl-1-methylcyclopropane (PubChem CID 524642) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 1-hexyl-1-methylcyclopropane.

Molecular Properties

Compound Name1-hexyl-1-methylcyclopropane
PubChem CID524642
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name1-hexyl-1-methylcyclopropane
SMILESCCCCCCC1(C)CC1
InChIInChI=1S/C10H20/c1-3-4-5-6-7-10(2)8-9-10/h3-9H2,1-2H3
InChIKeyMUUNHCADTLHWRS-UHFFFAOYSA-N
XLogP3.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.76
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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Frequently Asked Questions

What is the IUPAC name of 1-hexyl-1-methylcyclopropane?
The IUPAC name of 1-hexyl-1-methylcyclopropane (CID 524642) is 1-hexyl-1-methylcyclopropane.
What is the SMILES notation for 1-hexyl-1-methylcyclopropane?
The canonical SMILES for 1-hexyl-1-methylcyclopropane is CCCCCCC1(C)CC1.
What is the InChIKey of 1-hexyl-1-methylcyclopropane?
The InChIKey is MUUNHCADTLHWRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-3-4-5-6-7-10(2)8-9-10/h3-9H2,1-2H3.
What are the key properties of 1-hexyl-1-methylcyclopropane?
1-hexyl-1-methylcyclopropane has a molecular weight of 140.27 g/mol, XLogP of 3.76, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexyl-1-methylcyclopropane is sourced from PubChem (CID 524642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).