1,4-dimethyltricyclo[3.2.1.03,8]octane

C10H16 — CID 163690199

IUPAC1,4-dimethyltricyclo[3.2.1.03,8]octane
SMILESCC1C2CCC3(C)CC1C23
InChIInChI=1S/C10H16/c1-6-7-3-4-10(2)5-8(6)9(7)10/h6-9H,3-5H2,1-2H3
InChIKeyJSILDXBCZKTWHC-UHFFFAOYSA-N
MW136.24 g/mol
LogP2.69
Rot. Bonds

About 1,4-dimethyltricyclo[3.2.1.03,8]octane

1,4-dimethyltricyclo[3.2.1.03,8]octane (PubChem CID 163690199) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 1,4-dimethyltricyclo[3.2.1.03,8]octane.

Molecular Properties

Compound Name1,4-dimethyltricyclo[3.2.1.03,8]octane
PubChem CID163690199
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name1,4-dimethyltricyclo[3.2.1.03,8]octane
SMILESCC1C2CCC3(C)CC1C23
InChIInChI=1S/C10H16/c1-6-7-3-4-10(2)5-8(6)9(7)10/h6-9H,3-5H2,1-2H3
InChIKeyJSILDXBCZKTWHC-UHFFFAOYSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(3S,3aS,5aS,8S,9R,9aS,9bS)-8-hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-2-one
CID 11032365
(3S,3aS,5aS,8S,9R,9aS,9bR)-8-hydroxy-3,5a,9-trimethyl-3,3a,4,5,6,7,8,9,9a,9b-decahydrobenzo[g][1]benzofuran-2-one
CID 15624905
4,4,10-trimethyltricyclo[5.2.1.02,6]decane
CID 142502151
(3S,5aS,7R,9S,9aS)-7-iodo-3,5a,9-trimethyl-3a,4,5,6,7,9,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2,8-dione
CID 134924623
(3aR,3bR,6aR,7R,7aR)-4,4,7-trimethyl-3-methylidene-2,3a,3b,5,6,6a,7,7a-octahydro-1H-cyclopenta[a]pentalene
CID 12047285
2,3,4,5,7,7-hexamethylbicyclo[4.2.0]octane
CID 91082201
1-(4,6a,8,12a-tetramethyl-1,2,3,4,4a,4b,5,6,7,8,9,10,10a,10b,11,12-hexadecahydrochrysen-1-yl)ethanol
CID 155752417
(2S)-1,2,3,3-tetramethylbicyclo[2.2.1]heptane
CID 148935877
1-methyltetracyclo[6.2.1.13,6.02,7]dodecane
CID 12936587
3-cyclopentyl-3-methyl-7-(2,3,3-trimethylbutan-2-yl)bicyclo[4.1.0]heptane
CID 163885424
azane;5-methylbicyclo[2.1.0]pentane
CID 68525999
1,4,12,12-tetramethyl-8-methylidene-11-oxatetracyclo[8.5.1.03,7.013,16]hexadecane
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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyltricyclo[3.2.1.03,8]octane?
The IUPAC name of 1,4-dimethyltricyclo[3.2.1.03,8]octane (CID 163690199) is 1,4-dimethyltricyclo[3.2.1.03,8]octane.
What is the SMILES notation for 1,4-dimethyltricyclo[3.2.1.03,8]octane?
The canonical SMILES for 1,4-dimethyltricyclo[3.2.1.03,8]octane is CC1C2CCC3(C)CC1C23.
What is the InChIKey of 1,4-dimethyltricyclo[3.2.1.03,8]octane?
The InChIKey is JSILDXBCZKTWHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-6-7-3-4-10(2)5-8(6)9(7)10/h6-9H,3-5H2,1-2H3.
What are the key properties of 1,4-dimethyltricyclo[3.2.1.03,8]octane?
1,4-dimethyltricyclo[3.2.1.03,8]octane has a molecular weight of 136.24 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyltricyclo[3.2.1.03,8]octane is sourced from PubChem (CID 163690199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).