1-ethyl-1-(4-propylcyclohexyl)cyclohexane

C17H32 — CID 57009275

IUPAC1-ethyl-1-(4-propylcyclohexyl)cyclohexane
SMILESCCCC1CCC(C2(CC)CCCCC2)CC1
InChIInChI=1S/C17H32/c1-3-8-15-9-11-16(12-10-15)17(4-2)13-6-5-7-14-17/h15-16H,3-14H2,1-2H3
InChIKeyRRYRMIVOTYQVGZ-UHFFFAOYSA-N
MW236.44 g/mol
LogP5.95
Rot. Bonds4

About 1-ethyl-1-(4-propylcyclohexyl)cyclohexane

1-ethyl-1-(4-propylcyclohexyl)cyclohexane (PubChem CID 57009275) has the molecular formula C17H32 and a molecular weight of 236.44 g/mol. Its IUPAC name is 1-ethyl-1-(4-propylcyclohexyl)cyclohexane.

Molecular Properties

Compound Name1-ethyl-1-(4-propylcyclohexyl)cyclohexane
PubChem CID57009275
Molecular FormulaC17H32
Molecular Weight236.44 g/mol
Exact Mass236.25
IUPAC Name1-ethyl-1-(4-propylcyclohexyl)cyclohexane
SMILESCCCC1CCC(C2(CC)CCCCC2)CC1
InChIInChI=1S/C17H32/c1-3-8-15-9-11-16(12-10-15)17(4-2)13-6-5-7-14-17/h15-16H,3-14H2,1-2H3
InChIKeyRRYRMIVOTYQVGZ-UHFFFAOYSA-N
XLogP5.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.44
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1-bis(4-propylcyclohexyl)cyclohexane
CID 54232179
1-(1-fluoroethyl)-1-(4-propylcyclohexyl)cyclohexane
CID 173391449
3-propylspiro[5.6]dodecane
CID 163613469
1-(2-cyclohexylethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 70430254
1-ethylbicyclo[2.2.0]hexane
CID 90977886
propylcyclotetradecane
CID 90991550
2-(1-ethylcyclohexyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
CID 173085788
1,1-dimethyl-4-propylcyclotridecane
CID 123608299
3-cyclopropyl-3-ethylpiperidine
CID 64919354
ethane;propane;propylcyclopropane
CID 145406182
4-cyclohexyl-1-(4-ethylcyclohexyl)-1-propylcyclohexane
CID 173329798
7-propylspiro[3.5]nonane
CID 144910869

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(4-propylcyclohexyl)cyclohexane?
The IUPAC name of 1-ethyl-1-(4-propylcyclohexyl)cyclohexane (CID 57009275) is 1-ethyl-1-(4-propylcyclohexyl)cyclohexane.
What is the SMILES notation for 1-ethyl-1-(4-propylcyclohexyl)cyclohexane?
The canonical SMILES for 1-ethyl-1-(4-propylcyclohexyl)cyclohexane is CCCC1CCC(C2(CC)CCCCC2)CC1.
What is the InChIKey of 1-ethyl-1-(4-propylcyclohexyl)cyclohexane?
The InChIKey is RRYRMIVOTYQVGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32/c1-3-8-15-9-11-16(12-10-15)17(4-2)13-6-5-7-14-17/h15-16H,3-14H2,1-2H3.
What are the key properties of 1-ethyl-1-(4-propylcyclohexyl)cyclohexane?
1-ethyl-1-(4-propylcyclohexyl)cyclohexane has a molecular weight of 236.44 g/mol, XLogP of 5.95, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(4-propylcyclohexyl)cyclohexane is sourced from PubChem (CID 57009275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).