1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane

C15H30 — CID 123142246

IUPAC1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane
SMILESCCC(C)C(C)C(C)C(C)C1CC1CC
InChIInChI=1S/C15H30/c1-7-10(3)11(4)12(5)13(6)15-9-14(15)8-2/h10-15H,7-9H2,1-6H3
InChIKeyOKZSZVVBYLZFNT-UHFFFAOYSA-N
MW210.40 g/mol
LogP4.99
Rot. Bonds6

About 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane

1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane (PubChem CID 123142246) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane.

Molecular Properties

Compound Name1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane
PubChem CID123142246
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane
SMILESCCC(C)C(C)C(C)C(C)C1CC1CC
InChIInChI=1S/C15H30/c1-7-10(3)11(4)12(5)13(6)15-9-14(15)8-2/h10-15H,7-9H2,1-6H3
InChIKeyOKZSZVVBYLZFNT-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.40
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(3,4-dimethylpentan-2-yl)-2-ethylcyclopropane
CID 90998982
2-(3,4,5-trimethylheptan-2-yl)bicyclo[2.2.0]hexane
CID 123639406
1-ethyl-2-[3-(2-propan-2-ylcyclopropyl)butan-2-yl]cyclopropane
CID 123962294
3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19-heptadecamethylhenicosan-2-ylcyclopropane
CID 123401956
3,4,5,6,7,8,9,10,11,12,13,14,15-tridecamethylheptadecane
CID 168768999
2,4-dimethyl-6-(3,4,5,6-tetramethyloctan-2-yl)tricyclo[3.2.1.01,4]octane
CID 90738756
carbon dioxide;1-ethyl-2-propan-2-ylcyclopropane
CID 158990668
1-butan-2-yl-2-ethylcyclobutane
CID 91142944
1-ethyl-2-nonan-2-ylcyclopropane
CID 123964320
2-ethyl-3-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 142876945
ethane;3,4,5,6,7,8,9,10,11-nonamethyltridecane;sulfane;3,4,5,6-tetramethyloctane;tungsten
CID 162191243
3-ethyl-4-propan-2-ylbicyclo[4.1.0]heptane
CID 163871829

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane?
The IUPAC name of 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane (CID 123142246) is 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane.
What is the SMILES notation for 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane?
The canonical SMILES for 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane is CCC(C)C(C)C(C)C(C)C1CC1CC.
What is the InChIKey of 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane?
The InChIKey is OKZSZVVBYLZFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-7-10(3)11(4)12(5)13(6)15-9-14(15)8-2/h10-15H,7-9H2,1-6H3.
What are the key properties of 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane?
1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane has a molecular weight of 210.40 g/mol, XLogP of 4.99, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(3,4,5-trimethylheptan-2-yl)cyclopropane is sourced from PubChem (CID 123142246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).