bicyclo[5.3.1]undecane

C11H20 — CID 14399147

IUPACbicyclo[5.3.1]undecane
SMILESC1CCC2CCCC(CC1)C2
InChIInChI=1S/C11H20/c1-2-5-10-7-4-8-11(9-10)6-3-1/h10-11H,1-9H2
InChIKeyBAJIUXJJEOUUDP-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.76
Rot. Bonds

About bicyclo[5.3.1]undecane

bicyclo[5.3.1]undecane (PubChem CID 14399147) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is bicyclo[5.3.1]undecane.

Molecular Properties

Compound Namebicyclo[5.3.1]undecane
PubChem CID14399147
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Namebicyclo[5.3.1]undecane
SMILESC1CCC2CCCC(CC1)C2
InChIInChI=1S/C11H20/c1-2-5-10-7-4-8-11(9-10)6-3-1/h10-11H,1-9H2
InChIKeyBAJIUXJJEOUUDP-UHFFFAOYSA-N
XLogP3.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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
bicyclo[5.5.3]pentadecane
CID 59938678
bicyclo[2.2.1]heptane;bicyclo[3.1.1]heptane;bicyclo[2.1.1]hexane;bicyclo[3.2.1]octane;bicyclo[4.1.1]octane;bicyclo[1.1.1]pentane;spiro[4.5]decane;spiro[5.5]undecane
CID 159153074
7-oxabicyclo[11.11.1]pentacosane
CID 135063961
bicyclo[1.1.1]pentane;cyclobutane;cycloheptane;cyclohexane;cyclopentane;cyclopropane
CID 162048501
2,3,3a,4,5,6,7,7a-octahydro-1H-indene;1,2,3,3a,4,5,6,6a-octahydropentalene;bicyclo[2.2.1]heptane;bicyclo[3.2.0]heptane;bicyclo[4.1.0]heptane;bicyclo[2.1.1]hexane;bicyclo[3.2.2]nonane;bicyclo[3.3.1]nonane;bicyclo[4.2.1]nonane;bicyclo[5.2.0]nonane;bicyclo[2.2.2]octane;bicyclo[3.2.1]octane;bicyclo[4.1.1]octane;bicyclo[4.2.0]octane
CID 158844254
(3R,11S)-tricyclo[5.5.1.03,11]tridecane
CID 54121059
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;bicyclo[2.2.1]heptane;cycloheptane;methane
CID 142046247

Frequently Asked Questions

What is the IUPAC name of bicyclo[5.3.1]undecane?
The IUPAC name of bicyclo[5.3.1]undecane (CID 14399147) is bicyclo[5.3.1]undecane.
What is the SMILES notation for bicyclo[5.3.1]undecane?
The canonical SMILES for bicyclo[5.3.1]undecane is C1CCC2CCCC(CC1)C2.
What is the InChIKey of bicyclo[5.3.1]undecane?
The InChIKey is BAJIUXJJEOUUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-2-5-10-7-4-8-11(9-10)6-3-1/h10-11H,1-9H2.
What are the key properties of bicyclo[5.3.1]undecane?
bicyclo[5.3.1]undecane has a molecular weight of 152.28 g/mol, XLogP of 3.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[5.3.1]undecane is sourced from PubChem (CID 14399147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).