ethenylcyclotetradecane

C16H30 — CID 123915888

IUPACethenylcyclotetradecane
SMILESC=CC1CCCCCCCCCCCCC1
InChIInChI=1S/C16H30/c1-2-16-14-12-10-8-6-4-3-5-7-9-11-13-15-16/h2,16H,1,3-15H2
InChIKeyKAQVFAKRLUIPJJ-UHFFFAOYSA-N
MW222.42 g/mol
LogP5.87
Rot. Bonds1

About ethenylcyclotetradecane

ethenylcyclotetradecane (PubChem CID 123915888) has the molecular formula C16H30 and a molecular weight of 222.42 g/mol. Its IUPAC name is ethenylcyclotetradecane.

Molecular Properties

Compound Nameethenylcyclotetradecane
PubChem CID123915888
Molecular FormulaC16H30
Molecular Weight222.42 g/mol
Exact Mass222.23
IUPAC Nameethenylcyclotetradecane
SMILESC=CC1CCCCCCCCCCCCC1
InChIInChI=1S/C16H30/c1-2-16-14-12-10-8-6-4-3-5-7-9-11-13-15-16/h2,16H,1,3-15H2
InChIKeyKAQVFAKRLUIPJJ-UHFFFAOYSA-N
XLogP5.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.42
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethenylcyclononane
CID 123465789
ethenylcyclohexane;7-oxabicyclo[4.1.0]heptane
CID 175283052
4-ethenylcyclohexane-1-carbaldehyde
CID 15509286
3-ethenylcyclopentadecan-1-one
CID 11345719
ethenylcyclohexane;1-ethenyl-2-methylbenzene
CID 174828850
2-cyclohexylethenylcyclohexane
CID 4124459
1,3-bis(ethenyl)cyclohexane;ethane;methane
CID 145016611
cyclodecanecarbaldehyde
CID 13240747
cis-(1S,3R)-3-ethenylcyclohexan-1-ol
CID 15329925
1-ethenyl-4-(4-ethenylcyclohexyl)oxycyclohexane
CID 148702983
propa-1,2-dienylcyclooctane
CID 86021125
cyclooctane-1,4-dicarbaldehyde
CID 19884381

Frequently Asked Questions

What is the IUPAC name of ethenylcyclotetradecane?
The IUPAC name of ethenylcyclotetradecane (CID 123915888) is ethenylcyclotetradecane.
What is the SMILES notation for ethenylcyclotetradecane?
The canonical SMILES for ethenylcyclotetradecane is C=CC1CCCCCCCCCCCCC1.
What is the InChIKey of ethenylcyclotetradecane?
The InChIKey is KAQVFAKRLUIPJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30/c1-2-16-14-12-10-8-6-4-3-5-7-9-11-13-15-16/h2,16H,1,3-15H2.
What are the key properties of ethenylcyclotetradecane?
ethenylcyclotetradecane has a molecular weight of 222.42 g/mol, XLogP of 5.87, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethenylcyclotetradecane is sourced from PubChem (CID 123915888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).