pentacyclo[6.4.0.02,7.03,11.05,10]dodecane

C12H16 — CID 90708847

IUPACpentacyclo[6.4.0.02,7.03,11.05,10]dodecane
SMILESC1C2C3CC4C2CC2C1C(C3)C42
InChIInChI=1S/C12H16/c1-5-2-10-8-3-6(5)7-4-11(8)12(10)9(1)7/h5-12H,1-4H2
InChIKeyFBMRGEZOLKLMRE-UHFFFAOYSA-N
MW160.26 g/mol
LogP2.54
Rot. Bonds

About pentacyclo[6.4.0.02,7.03,11.05,10]dodecane

pentacyclo[6.4.0.02,7.03,11.05,10]dodecane (PubChem CID 90708847) has the molecular formula C12H16 and a molecular weight of 160.26 g/mol. Its IUPAC name is pentacyclo[6.4.0.02,7.03,11.05,10]dodecane.

Molecular Properties

Compound Namepentacyclo[6.4.0.02,7.03,11.05,10]dodecane
PubChem CID90708847
Molecular FormulaC12H16
Molecular Weight160.26 g/mol
Exact Mass160.13
IUPAC Namepentacyclo[6.4.0.02,7.03,11.05,10]dodecane
SMILESC1C2C3CC4C2CC2C1C(C3)C42
InChIInChI=1S/C12H16/c1-5-2-10-8-3-6(5)7-4-11(8)12(10)9(1)7/h5-12H,1-4H2
InChIKeyFBMRGEZOLKLMRE-UHFFFAOYSA-N
XLogP2.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

heptacyclo[12.2.1.110,13.02,5.03,16.06,9.08,11]octadecane
CID 59938675
(6R)-pentacyclo[5.4.0.02,6.03,5.08,10]undecane
CID 163852923
pentacyclo[6.4.1.02,6.03,13.05,11]tridecane
CID 163947804
pentacyclo[7.4.1.02,8.03,6.010,13]tetradecane
CID 90749400
pentacyclo[8.4.0.03,7.04,13.06,11]tetradecane
CID 604684
(1R,2R,4S,5S,6R)-tricyclo[3.2.1.02,4]octan-6-ol
CID 124536655
tetracyclo[5.1.0.02,4.03,5]octane
CID 12871558
2-methyl-5-[3-(3-methylcyclobutyl)-6-bicyclo[3.1.0]hexanyl]bicyclo[2.2.0]hexane
CID 152828720
(1S,2R,4S,5R,6S)-6-ethenyltricyclo[3.2.1.02,4]octane
CID 143370752
2-cyclopropyl-4-(2-cyclopropylcyclopropyl)bicyclo[1.1.0]butane
CID 123646465
4-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)tetracyclo[6.2.1.13,6.02,7]dodecane
CID 565737
heptacyclo[8.7.0.02,9.03,7.05,14.011,17.012,16]heptadecane
CID 90855618

Frequently Asked Questions

What is the IUPAC name of pentacyclo[6.4.0.02,7.03,11.05,10]dodecane?
The IUPAC name of pentacyclo[6.4.0.02,7.03,11.05,10]dodecane (CID 90708847) is pentacyclo[6.4.0.02,7.03,11.05,10]dodecane.
What is the SMILES notation for pentacyclo[6.4.0.02,7.03,11.05,10]dodecane?
The canonical SMILES for pentacyclo[6.4.0.02,7.03,11.05,10]dodecane is C1C2C3CC4C2CC2C1C(C3)C42.
What is the InChIKey of pentacyclo[6.4.0.02,7.03,11.05,10]dodecane?
The InChIKey is FBMRGEZOLKLMRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16/c1-5-2-10-8-3-6(5)7-4-11(8)12(10)9(1)7/h5-12H,1-4H2.
What are the key properties of pentacyclo[6.4.0.02,7.03,11.05,10]dodecane?
pentacyclo[6.4.0.02,7.03,11.05,10]dodecane has a molecular weight of 160.26 g/mol, XLogP of 2.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentacyclo[6.4.0.02,7.03,11.05,10]dodecane is sourced from PubChem (CID 90708847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).