1,2-diethyl-3,4-dimethylcyclobutane

C10H20 — CID 91590074

IUPAC1,2-diethyl-3,4-dimethylcyclobutane
SMILESCCC1C(C)C(C)C1CC
InChIInChI=1S/C10H20/c1-5-9-7(3)8(4)10(9)6-2/h7-10H,5-6H2,1-4H3
InChIKeyKQUIEMKGBKOQMQ-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.32
Rot. Bonds2

About 1,2-diethyl-3,4-dimethylcyclobutane

1,2-diethyl-3,4-dimethylcyclobutane (PubChem CID 91590074) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 1,2-diethyl-3,4-dimethylcyclobutane.

Molecular Properties

Compound Name1,2-diethyl-3,4-dimethylcyclobutane
PubChem CID91590074
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name1,2-diethyl-3,4-dimethylcyclobutane
SMILESCCC1C(C)C(C)C1CC
InChIInChI=1S/C10H20/c1-5-9-7(3)8(4)10(9)6-2/h7-10H,5-6H2,1-4H3
InChIKeyKQUIEMKGBKOQMQ-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

cis-(2R,3S)-1-ethyl-2,3-dimethylcyclopropane
CID 59954456
(5R)-1-ethyl-2,3,4,5,6-pentamethylcyclohexane
CID 143806596
1-ethyl-2-[2-(2-ethyl-3-methylcyclopropyl)ethyl]-3-methylcyclopropane
CID 90777753
1-chloro-2-ethyl-3,4-dimethylcyclobutane
CID 174674861
2-(2-ethyl-3-methylcyclopropyl)ethanol
CID 91526803
4-ethyl-9,10-dimethylpentacyclo[5.4.0.02,6.03,5.08,11]undecane
CID 123596860
3-ethyl-4,7,8-trimethyltricyclo[4.2.0.02,5]octane
CID 123396298
1,2,4-triethyl-3-methyl-5-propan-2-ylcyclopentane
CID 123693329
5-ethyl-6-methylbicyclo[2.1.1]hexane
CID 123324829
1,2-diethyl-3-[1-(2-ethyl-3-methylcyclopropyl)-2-methylpropan-2-yl]cyclopropane
CID 123380149
propane;bis(1,2,3,4-tetramethyl-5-[(2,3,4,5-tetramethylcyclopentyl)methyl]cyclopentane)
CID 162289417
1,2,3-trimethyl-4-propylcyclobutane
CID 90876457

Frequently Asked Questions

What is the IUPAC name of 1,2-diethyl-3,4-dimethylcyclobutane?
The IUPAC name of 1,2-diethyl-3,4-dimethylcyclobutane (CID 91590074) is 1,2-diethyl-3,4-dimethylcyclobutane.
What is the SMILES notation for 1,2-diethyl-3,4-dimethylcyclobutane?
The canonical SMILES for 1,2-diethyl-3,4-dimethylcyclobutane is CCC1C(C)C(C)C1CC.
What is the InChIKey of 1,2-diethyl-3,4-dimethylcyclobutane?
The InChIKey is KQUIEMKGBKOQMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-5-9-7(3)8(4)10(9)6-2/h7-10H,5-6H2,1-4H3.
What are the key properties of 1,2-diethyl-3,4-dimethylcyclobutane?
1,2-diethyl-3,4-dimethylcyclobutane has a molecular weight of 140.27 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethyl-3,4-dimethylcyclobutane is sourced from PubChem (CID 91590074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).