2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]

C12H20 — CID 123577776

IUPAC2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]
SMILESCCC1CC12CC1C2C1(C)CC
InChIInChI=1S/C12H20/c1-4-8-6-12(8)7-9-10(12)11(9,3)5-2/h8-10H,4-7H2,1-3H3
InChIKeyRNMHJCPYLICCJK-UHFFFAOYSA-N
MW164.29 g/mol
LogP3.47
Rot. Bonds2

About 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]

2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane] (PubChem CID 123577776) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane].

Molecular Properties

Compound Name2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]
PubChem CID123577776
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]
SMILESCCC1CC12CC1C2C1(C)CC
InChIInChI=1S/C12H20/c1-4-8-6-12(8)7-9-10(12)11(9,3)5-2/h8-10H,4-7H2,1-3H3
InChIKeyRNMHJCPYLICCJK-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane] with MolForge

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Related Compounds

1-cyclopropyl-1,2-diethylcyclopropane
CID 123652648
(2R)-2,3-diethyl-2,6,6-trimethylbicyclo[3.1.1]heptane
CID 143011520
2-ethyl-7,7-dimethyltetraspiro[2.0.0.0.26.15.14.13]undecane
CID 123467869
2-but-1-enyl-4-ethyl-2,4-dimethylbicyclo[1.1.0]butane
CID 123224638
2-ethyl-1-methyl-1-(2-methylcyclopropyl)cyclopropane
CID 123849923
2-(2-ethyl-1-methylcyclopropyl)-1,1,3-trimethylcyclopropane
CID 123601858
azane;2-ethyl-1,1-dimethylcyclobutane
CID 174315226
(2R)-2-ethyl-1,1-difluorocyclopropane
CID 123881327
4-ethyl-3,3-dimethylcyclohexan-1-ol
CID 58534383
2-(1,2-dimethylcyclobutyl)-1-ethylbicyclo[1.1.0]butane
CID 90876004
1,2-diethyl-1-methyl-3-propylcyclopropane
CID 90731440
2,6-diethyl-1-methylbicyclo[3.1.1]heptane
CID 123140222

Frequently Asked Questions

What is the IUPAC name of 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]?
The IUPAC name of 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane] (CID 123577776) is 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane].
What is the SMILES notation for 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]?
The canonical SMILES for 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane] is CCC1CC12CC1C2C1(C)CC.
What is the InChIKey of 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]?
The InChIKey is RNMHJCPYLICCJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20/c1-4-8-6-12(8)7-9-10(12)11(9,3)5-2/h8-10H,4-7H2,1-3H3.
What are the key properties of 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane]?
2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane] has a molecular weight of 164.29 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2',5-diethyl-5-methylspiro[bicyclo[2.1.0]pentane-2,1'-cyclopropane] is sourced from PubChem (CID 123577776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).