2-ethyl-1,1-dimethylcyclohexane

C10H20 — CID 19090156

IUPAC2-ethyl-1,1-dimethylcyclohexane
SMILESCCC1CCCCC1(C)C
InChIInChI=1S/C10H20/c1-4-9-7-5-6-8-10(9,2)3/h9H,4-8H2,1-3H3
InChIKeyHIVFIUIKABOGIO-UHFFFAOYSA-N
MW140.27 g/mol
LogP3.61
Rot. Bonds1

About 2-ethyl-1,1-dimethylcyclohexane

2-ethyl-1,1-dimethylcyclohexane (PubChem CID 19090156) has the molecular formula C10H20 and a molecular weight of 140.27 g/mol. Its IUPAC name is 2-ethyl-1,1-dimethylcyclohexane.

Molecular Properties

Compound Name2-ethyl-1,1-dimethylcyclohexane
PubChem CID19090156
Molecular FormulaC10H20
Molecular Weight140.27 g/mol
Exact Mass140.16
IUPAC Name2-ethyl-1,1-dimethylcyclohexane
SMILESCCC1CCCCC1(C)C
InChIInChI=1S/C10H20/c1-4-9-7-5-6-8-10(9,2)3/h9H,4-8H2,1-3H3
InChIKeyHIVFIUIKABOGIO-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.27
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,1-dimethylcyclohexane?
The IUPAC name of 2-ethyl-1,1-dimethylcyclohexane (CID 19090156) is 2-ethyl-1,1-dimethylcyclohexane.
What is the SMILES notation for 2-ethyl-1,1-dimethylcyclohexane?
The canonical SMILES for 2-ethyl-1,1-dimethylcyclohexane is CCC1CCCCC1(C)C.
What is the InChIKey of 2-ethyl-1,1-dimethylcyclohexane?
The InChIKey is HIVFIUIKABOGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-4-9-7-5-6-8-10(9,2)3/h9H,4-8H2,1-3H3.
What are the key properties of 2-ethyl-1,1-dimethylcyclohexane?
2-ethyl-1,1-dimethylcyclohexane has a molecular weight of 140.27 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,1-dimethylcyclohexane is sourced from PubChem (CID 19090156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).