11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane

C16H30 — CID 91043765

IUPAC11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane
SMILESCC(C)C1C(C)C2CCCCCCCCC21
InChIInChI=1S/C16H30/c1-12(2)16-13(3)14-10-8-6-4-5-7-9-11-15(14)16/h12-16H,4-11H2,1-3H3
InChIKeyYUKXETWZUTZDMA-UHFFFAOYSA-N
MW222.42 g/mol
LogP5.28
Rot. Bonds1

About 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane

11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane (PubChem CID 91043765) has the molecular formula C16H30 and a molecular weight of 222.42 g/mol. Its IUPAC name is 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane.

Molecular Properties

Compound Name11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane
PubChem CID91043765
Molecular FormulaC16H30
Molecular Weight222.42 g/mol
Exact Mass222.23
IUPAC Name11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane
SMILESCC(C)C1C(C)C2CCCCCCCCC21
InChIInChI=1S/C16H30/c1-12(2)16-13(3)14-10-8-6-4-5-7-9-11-15(14)16/h12-16H,4-11H2,1-3H3
InChIKeyYUKXETWZUTZDMA-UHFFFAOYSA-N
XLogP5.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.42
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1R,8R)-9-methylbicyclo[6.1.0]nonane
CID 12870202
7,8-dimethylbicyclo[4.2.0]octane;ethane
CID 158084419
7-methylbicyclo[4.1.0]heptane;propane
CID 143683188
1-cyclopropyl-2,4-dimethyl-3-propan-2-ylcyclopentane
CID 123954813
1-methyl-2-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 142470319
methane;propan-2-ylcyclotetradecane
CID 159882779
(2R,3R)-2-methyl-3-propan-2-ylbicyclo[2.2.2]octane
CID 158984587
8-methylbicyclo[4.2.0]octan-7-amine
CID 81421667
1-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol
CID 68614086
10,12-dimethyl-1,2,3,4,4a,4b,5,5a,5b,6,7,8,9,9a,10,10a,11,11a,12,12a-icosahydroindeno[2,1-b]fluorene;ethane;methane;propane
CID 162269085
N,8-dimethylbicyclo[4.2.0]octan-7-amine
CID 81422301
2-tert-butyl-1,3-dimethyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 59655988

Frequently Asked Questions

What is the IUPAC name of 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane?
The IUPAC name of 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane (CID 91043765) is 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane.
What is the SMILES notation for 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane?
The canonical SMILES for 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane is CC(C)C1C(C)C2CCCCCCCCC21.
What is the InChIKey of 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane?
The InChIKey is YUKXETWZUTZDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30/c1-12(2)16-13(3)14-10-8-6-4-5-7-9-11-15(14)16/h12-16H,4-11H2,1-3H3.
What are the key properties of 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane?
11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane has a molecular weight of 222.42 g/mol, XLogP of 5.28, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane is sourced from PubChem (CID 91043765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).