spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]

C7H10 — CID 123804812

IUPACspiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]
SMILESC1C2CC1C21CC1
InChIInChI=1S/C7H10/c1-2-7(1)5-3-6(7)4-5/h5-6H,1-4H2
InChIKeyKCSFZPGQAROMBG-UHFFFAOYSA-N
MW94.16 g/mol
LogP1.81
Rot. Bonds

About spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]

spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane] (PubChem CID 123804812) has the molecular formula C7H10 and a molecular weight of 94.16 g/mol. Its IUPAC name is spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane].

Molecular Properties

Compound Namespiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]
PubChem CID123804812
Molecular FormulaC7H10
Molecular Weight94.16 g/mol
Exact Mass94.08
IUPAC Namespiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]
SMILESC1C2CC1C21CC1
InChIInChI=1S/C7H10/c1-2-7(1)5-3-6(7)4-5/h5-6H,1-4H2
InChIKeyKCSFZPGQAROMBG-UHFFFAOYSA-N
XLogP1.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.16
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1-cyclopropylcyclopropyl)cyclopentane
CID 57169070
spiro[adamantane-2,4'-oxane]
CID 10512483
11,11-dimethyltetracyclo[5.3.1.03,9.05,9]undecane
CID 162243036
spiro[adamantane-2,3'-oxetane]
CID 22677097
CID 169426406
CID 169426406
11,12-dimethylidenetetracyclo[5.3.2.03,9.05,9]dodecane
CID 123450547
2,2,3,3-tetramethylbicyclo[2.1.1]hexane
CID 123143747
1,1-di(cyclooctyl)cyclooctane
CID 23107007
(1S,2S,4R)-spiro[bicyclo[2.2.1]heptane-3,1'-cyclopropane]-2-ol
CID 15761090
spiro[cyclobutane-1,7'-pentacyclo[7.4.2.16,8.01,4.012,14]hexadecane]
CID 58675403
(1R,4S)-2-methylspiro[bicyclo[2.2.1]heptane-3,1'-cyclopentane]-2-ol
CID 164833501
3-[1,5,8-tris(3-bicyclo[3.3.1]nonanyl)cyclotetradecyl]bicyclo[3.3.1]nonane
CID 142776851

Frequently Asked Questions

What is the IUPAC name of spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]?
The IUPAC name of spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane] (CID 123804812) is spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane].
What is the SMILES notation for spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]?
The canonical SMILES for spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane] is C1C2CC1C21CC1.
What is the InChIKey of spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]?
The InChIKey is KCSFZPGQAROMBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10/c1-2-7(1)5-3-6(7)4-5/h5-6H,1-4H2.
What are the key properties of spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane]?
spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane] has a molecular weight of 94.16 g/mol, XLogP of 1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[bicyclo[1.1.1]pentane-2,1'-cyclopropane] is sourced from PubChem (CID 123804812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).