1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane

C20H34 — CID 123585245

IUPAC1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane
SMILESCC1C(C)C2(C)C1(C)C1(C)C3(C)CC(C)(C)C3(C)C21C
InChIInChI=1S/C20H34/c1-12-13(2)17(7)16(12,6)19(9)15(5)11-14(3,4)18(15,8)20(17,19)10/h12-13H,11H2,1-10H3
InChIKeyJSFGLXZWTQUJIN-UHFFFAOYSA-N
MW274.49 g/mol
LogP5.77
Rot. Bonds

About 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane

1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane (PubChem CID 123585245) has the molecular formula C20H34 and a molecular weight of 274.49 g/mol. Its IUPAC name is 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane.

Molecular Properties

Compound Name1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane
PubChem CID123585245
Molecular FormulaC20H34
Molecular Weight274.49 g/mol
Exact Mass274.27
IUPAC Name1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane
SMILESCC1C(C)C2(C)C1(C)C1(C)C3(C)CC(C)(C)C3(C)C21C
InChIInChI=1S/C20H34/c1-12-13(2)17(7)16(12,6)19(9)15(5)11-14(3,4)18(15,8)20(17,19)10/h12-13H,11H2,1-10H3
InChIKeyJSFGLXZWTQUJIN-UHFFFAOYSA-N
XLogP5.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.49
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2,3,3,5,6,7,8-octamethyltricyclo[4.2.0.02,5]octane
CID 91455245
1,2,3,4,4,5,5,6,7,8,9,10,11,12,13,14-hexadecamethylhexacyclo[6.6.0.02,7.03,6.09,14.010,13]tetradecane
CID 123795452
1,2,3,4,4,5,5,6,7,8,8,9,10,11,11,13-hexadecamethylpentacyclo[7.4.0.02,7.03,6.010,13]tridecane
CID 123620916
1,2,3,4,5,6,7,8,8,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,24,25,26,27,28,29-triacontamethyl-22,23-di(propan-2-yl)tridecacyclo[14.13.0.02,15.03,14.04,13.05,12.06,11.07,10.017,29.018,28.019,27.020,26.021,25]nonacosane
CID 123667893
1,3,4,5,6,8,9,10,11,12-decamethylpentacyclo[5.4.1.03,10.04,12.05,9]dodecane
CID 123472690
1,2,2,4,6-pentamethyl-5-propan-2-ylbicyclo[2.2.0]hexane
CID 123188364
12-ethyl-1,3,4,5,6,7,8,9,10,13,14,15,16,17,18,19-hexadecamethyl-6-propan-2-yloctacyclo[9.8.0.03,18.04,17.05,16.07,15.08,14.09,13]nonadecane
CID 123250463
1,2,2,3,4,5,6,6-octamethylbicyclo[3.1.1]heptane
CID 123650644
(2R,5R)-1,2,3,4,5-pentamethyltricyclo[3.1.0.02,6]hexane
CID 163529293
CID 162401464
CID 162401464
(4S)-4-tert-butyl-1,1,2,2,3,4-hexamethylcyclopentane;ethane
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CID 167503016

Frequently Asked Questions

What is the IUPAC name of 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane?
The IUPAC name of 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane (CID 123585245) is 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane.
What is the SMILES notation for 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane?
The canonical SMILES for 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane is CC1C(C)C2(C)C1(C)C1(C)C3(C)CC(C)(C)C3(C)C21C.
What is the InChIKey of 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane?
The InChIKey is JSFGLXZWTQUJIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34/c1-12-13(2)17(7)16(12,6)19(9)15(5)11-14(3,4)18(15,8)20(17,19)10/h12-13H,11H2,1-10H3.
What are the key properties of 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane?
1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane has a molecular weight of 274.49 g/mol, XLogP of 5.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,3,5,6,7,8,9,10-decamethyltetracyclo[4.4.0.02,5.07,10]decane is sourced from PubChem (CID 123585245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).