bicyclo[5.5.3]pentadecane

C15H28 — CID 59938678

IUPACbicyclo[5.5.3]pentadecane
SMILESC1CCC2CCCCCC(CC1)CCC2
InChIInChI=1S/C15H28/c1-3-8-14-10-5-2-6-11-15(9-4-1)13-7-12-14/h14-15H,1-13H2
InChIKeyMTUUHWDRIAQFGQ-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.32
Rot. Bonds

About bicyclo[5.5.3]pentadecane

bicyclo[5.5.3]pentadecane (PubChem CID 59938678) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is bicyclo[5.5.3]pentadecane.

Molecular Properties

Compound Namebicyclo[5.5.3]pentadecane
PubChem CID59938678
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Namebicyclo[5.5.3]pentadecane
SMILESC1CCC2CCCCCC(CC1)CCC2
InChIInChI=1S/C15H28/c1-3-8-14-10-5-2-6-11-15(9-4-1)13-7-12-14/h14-15H,1-13H2
InChIKeyMTUUHWDRIAQFGQ-UHFFFAOYSA-N
XLogP5.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bicyclo[4.4.2]dodecane;cyclooctane
CID 158063107
bicyclo[112.2.2]octadecahectane
CID 91239791
bicyclo[5.3.1]undecane
CID 14399147
bicyclo[4.3.1]decane
CID 12592588
(1S,6R)-bicyclo[4.3.1]decane
CID 58154231
bicyclo[3.3.2]decane;bicyclo[4.2.2]decane;bicyclo[4.3.1]decane;bicyclo[2.2.1]heptane;bicyclo[3.1.1]heptane;bicyclo[3.3.1]nonane;bis(bicyclo[4.2.1]nonane);bicyclo[2.2.2]octane;bicyclo[3.2.1]octane
CID 160674450
bicyclo[3.3.2]decane;bicyclo[4.2.2]decane;bicyclo[4.3.3]dodecane;bicyclo[2.2.1]heptane;bicyclo[3.1.1]heptane;bicyclo[2.1.1]hexane;bicyclo[3.2.2]nonane;bicyclo[3.3.1]nonane;bicyclo[4.2.1]nonane;bicyclo[2.2.2]octane;bicyclo[3.2.1]octane;bicyclo[3.3.3]undecane;bis(bicyclo[4.3.2]undecane)
CID 158680471
bicyclo[3.3.2]decane;bicyclo[4.2.2]decane;bicyclo[4.3.1]decane;bicyclo[2.2.1]heptane;bicyclo[3.1.1]heptane;bicyclo[3.3.1]nonane;bicyclo[4.2.1]nonane;bicyclo[2.2.2]octane;bicyclo[3.2.1]octane;bicyclo[4.1.1]octane;bicyclo[4.3.2]undecane
CID 158767319
1-azabicyclo[8.8.8]hexacosane
CID 66583548
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1,2,3,3a,4,5,6,6a-octahydropentalene;cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane;cyclopropane
CID 158726060
1,2,3,3a,4,5,6,7,8,9,10,10a-dodecahydrocyclopenta[9]annulene
CID 58552309
(3aR,12aR)-1,2,3,3a,4,5,6,7,8,9,10,11,12,12a-tetradecahydrocyclopenta[11]annulene
CID 14112261

Frequently Asked Questions

What is the IUPAC name of bicyclo[5.5.3]pentadecane?
The IUPAC name of bicyclo[5.5.3]pentadecane (CID 59938678) is bicyclo[5.5.3]pentadecane.
What is the SMILES notation for bicyclo[5.5.3]pentadecane?
The canonical SMILES for bicyclo[5.5.3]pentadecane is C1CCC2CCCCCC(CC1)CCC2.
What is the InChIKey of bicyclo[5.5.3]pentadecane?
The InChIKey is MTUUHWDRIAQFGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-3-8-14-10-5-2-6-11-15(9-4-1)13-7-12-14/h14-15H,1-13H2.
What are the key properties of bicyclo[5.5.3]pentadecane?
bicyclo[5.5.3]pentadecane has a molecular weight of 208.39 g/mol, XLogP of 5.32, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[5.5.3]pentadecane is sourced from PubChem (CID 59938678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).