bicyclo[21.1.0]tetracosane

C24H46 — CID 123789596

IUPACbicyclo[21.1.0]tetracosane
SMILESC1CCCCCCCCCCC2CC2CCCCCCCCCC1
InChIInChI=1S/C24H46/c1-2-4-6-8-10-12-14-16-18-20-23-22-24(23)21-19-17-15-13-11-9-7-5-3-1/h23-24H,1-22H2
InChIKeyRWTHNHXENWGRSQ-UHFFFAOYSA-N
MW334.63 g/mol
LogP8.83
Rot. Bonds

About bicyclo[21.1.0]tetracosane

bicyclo[21.1.0]tetracosane (PubChem CID 123789596) has the molecular formula C24H46 and a molecular weight of 334.63 g/mol. Its IUPAC name is bicyclo[21.1.0]tetracosane.

Molecular Properties

Compound Namebicyclo[21.1.0]tetracosane
PubChem CID123789596
Molecular FormulaC24H46
Molecular Weight334.63 g/mol
Exact Mass334.36
IUPAC Namebicyclo[21.1.0]tetracosane
SMILESC1CCCCCCCCCCC2CC2CCCCCCCCCC1
InChIInChI=1S/C24H46/c1-2-4-6-8-10-12-14-16-18-20-23-22-24(23)21-19-17-15-13-11-9-7-5-3-1/h23-24H,1-22H2
InChIKeyRWTHNHXENWGRSQ-UHFFFAOYSA-N
XLogP8.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.63
LogP ≤ 58.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bicyclo[11.1.0]tetradecane
CID 90981498
(1R,6S)-bicyclo[4.1.0]heptane
CID 638054
pentacyclo[11.9.0.03,11.05,9.015,21]docosane
CID 132819456
CID 159099716
CID 159099716
bis(bicyclo[3.1.0]hexane);trihydrochloride
CID 69185190
tricyclo[4.3.1.12,5]undecane
CID 13070377
bicyclo[3.1.0]hexane;dihydrochloride
CID 141306080
(4aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 58427678
cyclohexylcycloheptane
CID 524589
cyclononylcycloicosane
CID 123187062
4-cyclobutylbicyclo[6.1.0]nonane
CID 123166023
2,3,3a,4,5,5a,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[f]azulene
CID 123828031

Frequently Asked Questions

What is the IUPAC name of bicyclo[21.1.0]tetracosane?
The IUPAC name of bicyclo[21.1.0]tetracosane (CID 123789596) is bicyclo[21.1.0]tetracosane.
What is the SMILES notation for bicyclo[21.1.0]tetracosane?
The canonical SMILES for bicyclo[21.1.0]tetracosane is C1CCCCCCCCCCC2CC2CCCCCCCCCC1.
What is the InChIKey of bicyclo[21.1.0]tetracosane?
The InChIKey is RWTHNHXENWGRSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46/c1-2-4-6-8-10-12-14-16-18-20-23-22-24(23)21-19-17-15-13-11-9-7-5-3-1/h23-24H,1-22H2.
What are the key properties of bicyclo[21.1.0]tetracosane?
bicyclo[21.1.0]tetracosane has a molecular weight of 334.63 g/mol, XLogP of 8.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[21.1.0]tetracosane is sourced from PubChem (CID 123789596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).