1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane

C11H20 — CID 123763181

IUPAC1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
SMILESCCC12CC1(C)CC2C(C)C
InChIInChI=1S/C11H20/c1-5-11-7-10(11,4)6-9(11)8(2)3/h8-9H,5-7H2,1-4H3
InChIKeySJSGWRVSUROEJC-UHFFFAOYSA-N
MW152.28 g/mol
LogP3.47
Rot. Bonds2

About 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane

1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane (PubChem CID 123763181) has the molecular formula C11H20 and a molecular weight of 152.28 g/mol. Its IUPAC name is 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane.

Molecular Properties

Compound Name1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
PubChem CID123763181
Molecular FormulaC11H20
Molecular Weight152.28 g/mol
Exact Mass152.16
IUPAC Name1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane
SMILESCCC12CC1(C)CC2C(C)C
InChIInChI=1S/C11H20/c1-5-11-7-10(11,4)6-9(11)8(2)3/h8-9H,5-7H2,1-4H3
InChIKeySJSGWRVSUROEJC-UHFFFAOYSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-ethyl-1-methyl-2-propan-2-ylcyclopropane
CID 91445155
1-ethyl-1,2-di(propan-2-yl)cyclopropane
CID 140630902
1-ethyl-2-propan-2-ylcyclopropane-1-carboxylic acid
CID 83826508
1-butyl-1-methyl-2-propan-2-ylcyclopropane
CID 91325328
1-ethyl-2-propan-2-yl-1-(trifluoromethyl)cyclopropane
CID 121274010
1-but-1-ynyl-1-methyl-2-propan-2-ylcyclopropane
CID 123938589
(8R,11S)-3-ethyl-3,8-dimethyl-11-propan-2-yl-2,4-dioxaspiro[5.5]undecane
CID 168973950
(2S)-2-ethyl-1,1-dimethyl-4-propan-2-ylcyclobutane
CID 162292361
2-ethyl-1,1-dimethyl-4-propan-2-ylcyclobutane
CID 91239546
2,2-diethyl-5-propan-2-ylpiperazine
CID 64884451
1,1-diethyl-3-propan-2-ylcyclobutane
CID 162172993
(2,2-dimethyl-3-propan-2-ylcyclobutyl)methanol
CID 175095277

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
The IUPAC name of 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane (CID 123763181) is 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane.
What is the SMILES notation for 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
The canonical SMILES for 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane is CCC12CC1(C)CC2C(C)C.
What is the InChIKey of 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
The InChIKey is SJSGWRVSUROEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-5-11-7-10(11,4)6-9(11)8(2)3/h8-9H,5-7H2,1-4H3.
What are the key properties of 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane?
1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane has a molecular weight of 152.28 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 1-ethyl-4-methyl-2-propan-2-ylbicyclo[2.1.0]pentane is sourced from PubChem (CID 123763181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).