1,1,2,2,3-pentaethylcyclohexane

C16H32 — CID 54223237

IUPAC1,1,2,2,3-pentaethylcyclohexane
SMILESCCC1CCCC(CC)(CC)C1(CC)CC
InChIInChI=1S/C16H32/c1-6-14-12-11-13-15(7-2,8-3)16(14,9-4)10-5/h14H,6-13H2,1-5H3
InChIKeyQZOXKDONCXAKED-UHFFFAOYSA-N
MW224.43 g/mol
LogP5.81
Rot. Bonds5

About 1,1,2,2,3-pentaethylcyclohexane

1,1,2,2,3-pentaethylcyclohexane (PubChem CID 54223237) has the molecular formula C16H32 and a molecular weight of 224.43 g/mol. Its IUPAC name is 1,1,2,2,3-pentaethylcyclohexane.

Molecular Properties

Compound Name1,1,2,2,3-pentaethylcyclohexane
PubChem CID54223237
Molecular FormulaC16H32
Molecular Weight224.43 g/mol
Exact Mass224.25
IUPAC Name1,1,2,2,3-pentaethylcyclohexane
SMILESCCC1CCCC(CC)(CC)C1(CC)CC
InChIInChI=1S/C16H32/c1-6-14-12-11-13-15(7-2,8-3)16(14,9-4)10-5/h14H,6-13H2,1-5H3
InChIKeyQZOXKDONCXAKED-UHFFFAOYSA-N
XLogP5.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.43
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

alumane;1,2-diethylcyclopentan-1-ol
CID 174746701
trans-(1R,2S)-1,2-diethylcyclohexan-1-ol
CID 86308413
2,2-diethylcyclopentan-1-amine
CID 165447049
1,2-diethylcycloheptane-1-thiol
CID 19850360
2-ethyl-1-fluoro-N-methylcyclopentan-1-amine
CID 171512621
2-ethyl-1-hydroxycyclopentane-1-sulfonic acid
CID 103574067
(2R)-2-ethylspiro[2.4]heptane
CID 147630807
(1,2-diethylcyclopentanecarbonyl)phosphonic acid
CID 57348632
1-(3,4-dimethylpentyl)-2-ethyl-1-methylcyclopentane
CID 145235208
(2,2,3-triethyl-1-silyloxycyclopentyl)methanol
CID 173330053
1,2-diethylcyclohexane-1-carbaldehyde
CID 138734421
2-(2-ethyl-1-hydroxycyclopentyl)acetaldehyde
CID 114795390

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3-pentaethylcyclohexane?
The IUPAC name of 1,1,2,2,3-pentaethylcyclohexane (CID 54223237) is 1,1,2,2,3-pentaethylcyclohexane.
What is the SMILES notation for 1,1,2,2,3-pentaethylcyclohexane?
The canonical SMILES for 1,1,2,2,3-pentaethylcyclohexane is CCC1CCCC(CC)(CC)C1(CC)CC.
What is the InChIKey of 1,1,2,2,3-pentaethylcyclohexane?
The InChIKey is QZOXKDONCXAKED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32/c1-6-14-12-11-13-15(7-2,8-3)16(14,9-4)10-5/h14H,6-13H2,1-5H3.
What are the key properties of 1,1,2,2,3-pentaethylcyclohexane?
1,1,2,2,3-pentaethylcyclohexane has a molecular weight of 224.43 g/mol, XLogP of 5.81, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3-pentaethylcyclohexane is sourced from PubChem (CID 54223237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).