1-(6-ethenylundecan-5-yl)-2-methylcyclopropane

C17H32 — CID 123814770

IUPAC1-(6-ethenylundecan-5-yl)-2-methylcyclopropane
SMILESC=CC(CCCCC)C(CCCC)C1CC1C
InChIInChI=1S/C17H32/c1-5-8-10-11-15(7-3)16(12-9-6-2)17-13-14(17)4/h7,14-17H,3,5-6,8-13H2,1-2,4H3
InChIKeyVSDSTVLJOSBHMS-UHFFFAOYSA-N
MW236.44 g/mol
LogP5.83
Rot. Bonds10

About 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane

1-(6-ethenylundecan-5-yl)-2-methylcyclopropane (PubChem CID 123814770) has the molecular formula C17H32 and a molecular weight of 236.44 g/mol. Its IUPAC name is 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane.

Molecular Properties

Compound Name1-(6-ethenylundecan-5-yl)-2-methylcyclopropane
PubChem CID123814770
Molecular FormulaC17H32
Molecular Weight236.44 g/mol
Exact Mass236.25
IUPAC Name1-(6-ethenylundecan-5-yl)-2-methylcyclopropane
SMILESC=CC(CCCCC)C(CCCC)C1CC1C
InChIInChI=1S/C17H32/c1-5-8-10-11-15(7-3)16(12-9-6-2)17-13-14(17)4/h7,14-17H,3,5-6,8-13H2,1-2,4H3
InChIKeyVSDSTVLJOSBHMS-UHFFFAOYSA-N
XLogP5.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.44
LogP ≤ 55.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-2-(2-methyloctan-3-yl)cyclopropane
CID 123773820
1-methyl-2-(3-methylnonan-4-yl)cyclopropane
CID 91046160
1-heptan-2-yl-2-methylcyclopropane
CID 91084036
N-methyl-1-(2-methylcyclopropyl)undecan-1-amine
CID 65419745
N-methyl-1-(2-methylcyclopropyl)pentan-1-amine
CID 65419536
2-dodec-1-en-3-ylpropanedioic acid
CID 59411846
3-ethenylnon-1-ene
CID 123641938
1-methyl-2-pent-1-en-3-ylcyclopropane
CID 91325896
10-ethenyl-11-(2-fluoroethyl)icosane
CID 57074959
(9R,10R)-10-ethenyl-9-methoxynonadecane
CID 102492829
3-chloronon-1-ene
CID 3021823
1-(2-methylcyclopropyl)octylhydrazine
CID 105234832

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane?
The IUPAC name of 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane (CID 123814770) is 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane.
What is the SMILES notation for 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane?
The canonical SMILES for 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane is C=CC(CCCCC)C(CCCC)C1CC1C.
What is the InChIKey of 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane?
The InChIKey is VSDSTVLJOSBHMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32/c1-5-8-10-11-15(7-3)16(12-9-6-2)17-13-14(17)4/h7,14-17H,3,5-6,8-13H2,1-2,4H3.
What are the key properties of 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane?
1-(6-ethenylundecan-5-yl)-2-methylcyclopropane has a molecular weight of 236.44 g/mol, XLogP of 5.83, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethenylundecan-5-yl)-2-methylcyclopropane is sourced from PubChem (CID 123814770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).