(5R)-3-ethylbicyclo[3.3.1]nonane

C11H20 — CID 59897306

IUPAC(5R)-3-ethylbicyclo[3.3.1]nonane
SMILESCCC1CC2CCC[C@H](C1)C2
InChIInChI=1S/C11H20/c1-2-9-6-10-4-3-5-11(7-9)8-10/h9-11H,2-8H2,1H3/t9?,10-,11?/m1/s1
InChIKeyDSDPWOMEHMJPOH-HSOILSAZSA-N
MW152.28 g/mol
LogP3.61
Rot. Bonds1

About (5R)-3-ethylbicyclo[3.3.1]nonane

(5R)-3-ethylbicyclo[3.3.1]nonane (PubChem CID 59897306) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is (5R)-3-ethylbicyclo[3.3.1]nonane.

Molecular Properties

Compound Name(5R)-3-ethylbicyclo[3.3.1]nonane
PubChem CID59897306
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name(5R)-3-ethylbicyclo[3.3.1]nonane
SMILESCCC1CC2CCC[C@H](C1)C2
InChIInChI=1S/C11H20/c1-2-9-6-10-4-3-5-11(7-9)8-10/h9-11H,2-8H2,1H3/t9?,10-,11?/m1/s1
InChIKeyDSDPWOMEHMJPOH-HSOILSAZSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-ethylbicyclo[3.1.1]heptane
CID 59715790
1-(2-cyclobutylethyl)-3-ethylcyclobutane
CID 123886657
8-(2,2-dimethylpropyl)bicyclo[4.3.1]decane
CID 140778092
bicyclo[3.1.1]heptane;bicyclo[4.1.0]heptane;ethane;propane
CID 90909345
3-ethyl-9-iodobicyclo[3.3.1]nonane
CID 134444057
ethylcyclobutane;methanamine
CID 175532329
1-chloro-3-ethylcyclobutane
CID 57207865
cyclopropane;ethylcyclobutane;propane
CID 142456817
3-ethyl-7-propan-2-ylbicyclo[3.3.1]nonane
CID 76732971
1,3-diethylcyclobutane;methane;propane
CID 161327157
1,3-diethylcyclopentane
CID 530396
3-ethyl-9λ4-thiabicyclo[3.3.1]nonane 9-oxide
CID 171950992

Frequently Asked Questions

What is the IUPAC name of (5R)-3-ethylbicyclo[3.3.1]nonane?
The IUPAC name of (5R)-3-ethylbicyclo[3.3.1]nonane (CID 59897306) is (5R)-3-ethylbicyclo[3.3.1]nonane.
What is the SMILES notation for (5R)-3-ethylbicyclo[3.3.1]nonane?
The canonical SMILES for (5R)-3-ethylbicyclo[3.3.1]nonane is CCC1CC2CCC[C@H](C1)C2.
What is the InChIKey of (5R)-3-ethylbicyclo[3.3.1]nonane?
The InChIKey is DSDPWOMEHMJPOH-HSOILSAZSA-N. The full InChI is InChI=1S/C11H20/c1-2-9-6-10-4-3-5-11(7-9)8-10/h9-11H,2-8H2,1H3/t9?,10-,11?/m1/s1.
What are the key properties of (5R)-3-ethylbicyclo[3.3.1]nonane?
(5R)-3-ethylbicyclo[3.3.1]nonane has a molecular weight of 152.28 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-ethylbicyclo[3.3.1]nonane is sourced from PubChem (CID 59897306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).