(1S,6R)-bicyclo[4.3.1]decane

C10H18 — CID 58154231

IUPAC(1S,6R)-bicyclo[4.3.1]decane
SMILESC1CC[C@H]2CCC[C@@H](C1)C2
InChIInChI=1S/C10H18/c1-2-5-10-7-3-6-9(4-1)8-10/h9-10H,1-8H2/t9-,10+
InChIKeyQEGGPUAKCVWNOT-AOOOYVTPSA-N
MW138.25 g/mol
LogP3.37
Rot. Bonds

About (1S,6R)-bicyclo[4.3.1]decane

(1S,6R)-bicyclo[4.3.1]decane (PubChem CID 58154231) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is (1S,6R)-bicyclo[4.3.1]decane.

Molecular Properties

Compound Name(1S,6R)-bicyclo[4.3.1]decane
PubChem CID58154231
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Name(1S,6R)-bicyclo[4.3.1]decane
SMILESC1CC[C@H]2CCC[C@@H](C1)C2
InChIInChI=1S/C10H18/c1-2-5-10-7-3-6-9(4-1)8-10/h9-10H,1-8H2/t9-,10+
InChIKeyQEGGPUAKCVWNOT-AOOOYVTPSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bicyclo[4.3.1]decane
CID 12592588
bicyclo[5.3.1]undecane
CID 14399147
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
(3R,11S)-tricyclo[5.5.1.03,11]tridecane
CID 54121059
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
bicyclo[4.2.2]decane;bicyclo[4.3.1]decane;bicyclo[4.3.3]dodecane;bis(bicyclo[3.3.1]nonane);bicyclo[4.2.1]nonane;bicyclo[2.2.2]octane;bicyclo[3.3.3]undecane;bicyclo[4.3.2]undecane;bis(tricyclo[4.2.1.02,5]nonane)
CID 159256082
7-oxabicyclo[11.11.1]pentacosane
CID 135063961
acetaldehyde;bicyclo[3.2.1]octane
CID 155693421
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

Frequently Asked Questions

What is the IUPAC name of (1S,6R)-bicyclo[4.3.1]decane?
The IUPAC name of (1S,6R)-bicyclo[4.3.1]decane (CID 58154231) is (1S,6R)-bicyclo[4.3.1]decane.
What is the SMILES notation for (1S,6R)-bicyclo[4.3.1]decane?
The canonical SMILES for (1S,6R)-bicyclo[4.3.1]decane is C1CC[C@H]2CCC[C@@H](C1)C2.
What is the InChIKey of (1S,6R)-bicyclo[4.3.1]decane?
The InChIKey is QEGGPUAKCVWNOT-AOOOYVTPSA-N. The full InChI is InChI=1S/C10H18/c1-2-5-10-7-3-6-9(4-1)8-10/h9-10H,1-8H2/t9-,10+.
What are the key properties of (1S,6R)-bicyclo[4.3.1]decane?
(1S,6R)-bicyclo[4.3.1]decane has a molecular weight of 138.25 g/mol, XLogP of 3.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,6R)-bicyclo[4.3.1]decane is sourced from PubChem (CID 58154231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).