1-ethyl-1,2,2-trimethylcyclopropane

C8H16 — CID 13115325

IUPAC1-ethyl-1,2,2-trimethylcyclopropane
SMILESCCC1(C)CC1(C)C
InChIInChI=1S/C8H16/c1-5-8(4)6-7(8,2)3/h5-6H2,1-4H3
InChIKeyCBKVKJDWYRUKGH-UHFFFAOYSA-N
MW112.22 g/mol
LogP2.83
Rot. Bonds1

About 1-ethyl-1,2,2-trimethylcyclopropane

1-ethyl-1,2,2-trimethylcyclopropane (PubChem CID 13115325) has the molecular formula C8H16 and a molecular weight of 112.22 g/mol. Its IUPAC name is 1-ethyl-1,2,2-trimethylcyclopropane.

Molecular Properties

Compound Name1-ethyl-1,2,2-trimethylcyclopropane
PubChem CID13115325
Molecular FormulaC8H16
Molecular Weight112.22 g/mol
Exact Mass112.13
IUPAC Name1-ethyl-1,2,2-trimethylcyclopropane
SMILESCCC1(C)CC1(C)C
InChIInChI=1S/C8H16/c1-5-8(4)6-7(8,2)3/h5-6H2,1-4H3
InChIKeyCBKVKJDWYRUKGH-UHFFFAOYSA-N
XLogP2.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.22
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(bromomethyl)-1,2,2-trimethylcyclopropane
CID 165442434
1-hexyl-1,2,2-trimethylcyclopropane
CID 123520586
1,1,2-trimethyl-2-(2-methylpropyl)cyclopropane
CID 123147679
1,2-diethyl-2-methylcyclopropane-1-carboxylic acid
CID 21319578
1,2,3-triethyl-1,2-dimethyl-3-propylcyclobutane
CID 59073306
CID 173226299
CID 173226299
(2R)-2-ethyl-2-methyl-5,7-diazaspiro[2.5]octane-4,6,8-trione
CID 129452353
1,1,3-triethyl-3-methylcyclobutane
CID 123991500
cis-(1S,2R)-1,2-diethyl-1,2-dimethyl-4-propylcyclopentane
CID 143682389
1-(2-ethylhexyl)-1,2,2-trimethylcyclopropane
CID 123492953
1-ethyl-2-methyl-2-propylcyclopropan-1-ol
CID 123991242
[(3S,4R)-4-ethyl-3,4-dimethylpyrrolidin-3-yl]methanol
CID 138468400

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1,2,2-trimethylcyclopropane?
The IUPAC name of 1-ethyl-1,2,2-trimethylcyclopropane (CID 13115325) is 1-ethyl-1,2,2-trimethylcyclopropane.
What is the SMILES notation for 1-ethyl-1,2,2-trimethylcyclopropane?
The canonical SMILES for 1-ethyl-1,2,2-trimethylcyclopropane is CCC1(C)CC1(C)C.
What is the InChIKey of 1-ethyl-1,2,2-trimethylcyclopropane?
The InChIKey is CBKVKJDWYRUKGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16/c1-5-8(4)6-7(8,2)3/h5-6H2,1-4H3.
What are the key properties of 1-ethyl-1,2,2-trimethylcyclopropane?
1-ethyl-1,2,2-trimethylcyclopropane has a molecular weight of 112.22 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1,2,2-trimethylcyclopropane is sourced from PubChem (CID 13115325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).