tetracyclo[8.2.1.02,9.03,7]tridecane

C13H20 — CID 117070325

IUPACtetracyclo[8.2.1.02,9.03,7]tridecane
SMILESC1CC2CC3C4CCC(C4)C3C2C1
InChIInChI=1S/C13H20/c1-2-8-7-12-9-4-5-10(6-9)13(12)11(8)3-1/h8-13H,1-7H2
InChIKeyFONGDJLYNQZXKW-UHFFFAOYSA-N
MW176.30 g/mol
LogP3.47
Rot. Bonds

About tetracyclo[8.2.1.02,9.03,7]tridecane

tetracyclo[8.2.1.02,9.03,7]tridecane (PubChem CID 117070325) has the molecular formula C13H20 and a molecular weight of 176.30 g/mol. Its IUPAC name is tetracyclo[8.2.1.02,9.03,7]tridecane.

Molecular Properties

Compound Nametetracyclo[8.2.1.02,9.03,7]tridecane
PubChem CID117070325
Molecular FormulaC13H20
Molecular Weight176.30 g/mol
Exact Mass176.16
IUPAC Nametetracyclo[8.2.1.02,9.03,7]tridecane
SMILESC1CC2CC3C4CCC(C4)C3C2C1
InChIInChI=1S/C13H20/c1-2-8-7-12-9-4-5-10(6-9)13(12)11(8)3-1/h8-13H,1-7H2
InChIKeyFONGDJLYNQZXKW-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tetracyclo[9.2.1.02,10.03,8]tetradecane
CID 6850833
tetrakis(pentacyclo[6.5.1.13,6.02,7.09,13]pentadecane);tris(pentacyclo[9.2.1.14,7.02,10.03,8]pentadecane)
CID 158145834
9-[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)cyclohexyl]-10-[6-(1,2,3,4,4a,4b,5,6,7,8,8a,8b-dodecahydrobiphenylen-1-yl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl]-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracene
CID 144809758
tricyclo[4.4.0.02,8]decane
CID 585864
(7S)-tricyclo[5.2.1.02,6]decane
CID 154529079
tetracyclo[6.3.1.02,6.010,12]dodecane
CID 146743747
11-[3-(2,3,4,4a,4b,5,6,7,8,8a,9,9a-dodecahydro-1H-fluoren-4-yl)-5-(6-cyclohexyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)cyclohexyl]-8-cyclohexyl-2,3,4,4a,5,6,6a,7,7a,8,9,10,11,11a,11b,11c-hexadecahydro-1H-benzo[c]fluorene
CID 167402176
tetracyclo[10.2.1.05,14.08,13]pentadecane
CID 13164121
hexadecacyclo[22.22.2.03,8.07,12.09,47.010,23.011,20.014,19.018,31.021,30.022,27.025,42.026,39.028,37.029,34.044,48]octatetracontane
CID 140677748
2-[2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)cyclohexyl]-1,2,3,3a,4,5,5a,6,7,8,8a,9,10,10a,10b,10c-hexadecahydropyrene
CID 164666249
(1R,2R,4S,8S)-tricyclo[6.1.0.02,4]nonane
CID 10964484
ethane;tricyclo[4.4.0.02,8]decane
CID 91556011

Frequently Asked Questions

What is the IUPAC name of tetracyclo[8.2.1.02,9.03,7]tridecane?
The IUPAC name of tetracyclo[8.2.1.02,9.03,7]tridecane (CID 117070325) is tetracyclo[8.2.1.02,9.03,7]tridecane.
What is the SMILES notation for tetracyclo[8.2.1.02,9.03,7]tridecane?
The canonical SMILES for tetracyclo[8.2.1.02,9.03,7]tridecane is C1CC2CC3C4CCC(C4)C3C2C1.
What is the InChIKey of tetracyclo[8.2.1.02,9.03,7]tridecane?
The InChIKey is FONGDJLYNQZXKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20/c1-2-8-7-12-9-4-5-10(6-9)13(12)11(8)3-1/h8-13H,1-7H2.
What are the key properties of tetracyclo[8.2.1.02,9.03,7]tridecane?
tetracyclo[8.2.1.02,9.03,7]tridecane has a molecular weight of 176.30 g/mol, XLogP of 3.47, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracyclo[8.2.1.02,9.03,7]tridecane is sourced from PubChem (CID 117070325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).