2-(2-cyclopropylethenyl)adamantane

C15H22 — CID 141496914

IUPAC2-(2-cyclopropylethenyl)adamantane
SMILESC(=CC1C2CC3CC(C2)CC1C3)C1CC1
InChIInChI=1S/C15H22/c1-2-10(1)3-4-15-13-6-11-5-12(8-13)9-14(15)7-11/h3-4,10-15H,1-2,5-9H2
InChIKeyPABVZIFMGIIJAO-UHFFFAOYSA-N
MW202.34 g/mol
LogP4.02
Rot. Bonds2

About 2-(2-cyclopropylethenyl)adamantane

2-(2-cyclopropylethenyl)adamantane (PubChem CID 141496914) has the molecular formula C15H22 and a molecular weight of 202.34 g/mol. Its IUPAC name is 2-(2-cyclopropylethenyl)adamantane.

Molecular Properties

Compound Name2-(2-cyclopropylethenyl)adamantane
PubChem CID141496914
Molecular FormulaC15H22
Molecular Weight202.34 g/mol
Exact Mass202.17
IUPAC Name2-(2-cyclopropylethenyl)adamantane
SMILESC(=CC1C2CC3CC(C2)CC1C3)C1CC1
InChIInChI=1S/C15H22/c1-2-10(1)3-4-15-13-6-11-5-12(8-13)9-14(15)7-11/h3-4,10-15H,1-2,5-9H2
InChIKeyPABVZIFMGIIJAO-UHFFFAOYSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 54.02
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

2-[(E)-2-iodoethenyl]adamantane
CID 171362143
pentacyclo[9.5.1.13,9.15,15.17,13]icosane
CID 86001136
1-[(E)-prop-1-enyl]-4-[(E)-2-[4-[4-[(E)-prop-1-enyl]cyclohexyl]cyclohexyl]ethenyl]cyclohexane
CID 59431504
1-ethyl-4-[2-(4-ethylcyclohexyl)ethenyl]cyclohexane
CID 140739356
2-[2-(2-adamantyl)ethynyl]adamantane
CID 19857439
(3R,11S)-tricyclo[5.5.1.03,11]tridecane
CID 54121059
2-iodoadamantane
CID 584609
adamantane;ruthenium(2+)
CID 175795757
ethyl 3-(2-adamantyl)-2-methylprop-2-enoate
CID 66689875
adamantane;hydrobromide
CID 68587587
adamantane;hydrate
CID 137498586
(E)-3-cyclopropylprop-2-en-1-amine
CID 63970491

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethenyl)adamantane?
The IUPAC name of 2-(2-cyclopropylethenyl)adamantane (CID 141496914) is 2-(2-cyclopropylethenyl)adamantane.
What is the SMILES notation for 2-(2-cyclopropylethenyl)adamantane?
The canonical SMILES for 2-(2-cyclopropylethenyl)adamantane is C(=CC1C2CC3CC(C2)CC1C3)C1CC1.
What is the InChIKey of 2-(2-cyclopropylethenyl)adamantane?
The InChIKey is PABVZIFMGIIJAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22/c1-2-10(1)3-4-15-13-6-11-5-12(8-13)9-14(15)7-11/h3-4,10-15H,1-2,5-9H2.
What are the key properties of 2-(2-cyclopropylethenyl)adamantane?
2-(2-cyclopropylethenyl)adamantane has a molecular weight of 202.34 g/mol, XLogP of 4.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethenyl)adamantane is sourced from PubChem (CID 141496914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).