2,2-dicyclopropylethylcyclobutane

C12H20 — CID 57317303

IUPAC2,2-dicyclopropylethylcyclobutane
SMILESC1CC(CC(C2CC2)C2CC2)C1
InChIInChI=1S/C12H20/c1-2-9(3-1)8-12(10-4-5-10)11-6-7-11/h9-12H,1-8H2
InChIKeyRWPHQAGDMYZMCD-UHFFFAOYSA-N
MW164.29 g/mol
LogP3.61
Rot. Bonds4

About 2,2-dicyclopropylethylcyclobutane

2,2-dicyclopropylethylcyclobutane (PubChem CID 57317303) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 2,2-dicyclopropylethylcyclobutane.

Molecular Properties

Compound Name2,2-dicyclopropylethylcyclobutane
PubChem CID57317303
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name2,2-dicyclopropylethylcyclobutane
SMILESC1CC(CC(C2CC2)C2CC2)C1
InChIInChI=1S/C12H20/c1-2-9(3-1)8-12(10-4-5-10)11-6-7-11/h9-12H,1-8H2
InChIKeyRWPHQAGDMYZMCD-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-dicyclohexylethylcyclohexane
CID 158413043
4-[2,2-bis(4-hydroxycyclohexyl)ethyl]cyclohexan-1-ol
CID 138556605
1,2-di(cyclobutyl)ethanamine
CID 65456758
2-cyclopropylpropylcyclobutane
CID 54087952
3-(2,2-dicyclohexylethyl)-9-methyl-9-azabicyclo[3.3.1]nonane
CID 86096115
2-cyclobutyl-1-cycloheptylethanamine
CID 65457005
(1-cyclobutyl-3-cyclopentylpropan-2-yl)cyclohexane
CID 174717926
(2S)-1-cyclobutylpropan-2-amine
CID 66713874
(2R)-1-cyclobutylpropan-2-amine
CID 124506916
3-cyclobutyl-2-cyclopropylpropanoic acid
CID 115013430
2-cycloheptyl-1-cyclopentylethanamine
CID 115779065
(1S)-1,2-dicyclohexylethanamine
CID 44574818

Frequently Asked Questions

What is the IUPAC name of 2,2-dicyclopropylethylcyclobutane?
The IUPAC name of 2,2-dicyclopropylethylcyclobutane (CID 57317303) is 2,2-dicyclopropylethylcyclobutane.
What is the SMILES notation for 2,2-dicyclopropylethylcyclobutane?
The canonical SMILES for 2,2-dicyclopropylethylcyclobutane is C1CC(CC(C2CC2)C2CC2)C1.
What is the InChIKey of 2,2-dicyclopropylethylcyclobutane?
The InChIKey is RWPHQAGDMYZMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-2-9(3-1)8-12(10-4-5-10)11-6-7-11/h9-12H,1-8H2.
What are the key properties of 2,2-dicyclopropylethylcyclobutane?
2,2-dicyclopropylethylcyclobutane has a molecular weight of 164.29 g/mol, XLogP of 3.61, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dicyclopropylethylcyclobutane is sourced from PubChem (CID 57317303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).