1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane

C18H34O — CID 19850412

IUPAC1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane
SMILESCCCC1CCC(C2CCC(COCC)CC2)CC1
InChIInChI=1S/C18H34O/c1-3-5-15-6-10-17(11-7-15)18-12-8-16(9-13-18)14-19-4-2/h15-18H,3-14H2,1-2H3
InChIKeyZPNMWOXDKPZJJA-UHFFFAOYSA-N
MW266.47 g/mol
LogP5.44
Rot. Bonds6

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

1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane (PubChem CID 19850412) has the molecular formula C18H34O and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane.

Molecular Properties

Compound Name1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane
PubChem CID19850412
Molecular FormulaC18H34O
Molecular Weight266.47 g/mol
Exact Mass266.26
IUPAC Name1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane
SMILESCCCC1CCC(C2CCC(COCC)CC2)CC1
InChIInChI=1S/C18H34O/c1-3-5-15-6-10-17(11-7-15)18-12-8-16(9-13-18)14-19-4-2/h15-18H,3-14H2,1-2H3
InChIKeyZPNMWOXDKPZJJA-UHFFFAOYSA-N
XLogP5.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.47
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-ethoxyethyl)-4-(ethoxymethyl)cyclohexane
CID 134545035
1-ethyl-4-[4-[[4-(4-propylcyclohexyl)cyclohexyl]methoxy]cyclohexyl]cyclohexane
CID 22886261
1-methyl-4-[[4-(4-propylcyclohexyl)cyclohexyl]methoxy]cyclohexane
CID 22886280
1-methyl-4-(4-propylcyclohexyl)cyclohexane
CID 543958
1-[[(Z)-but-2-enoxy]methyl]-4-(4-butylcyclohexyl)cyclohexane
CID 67898877
1-(prop-2-enoxymethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 19899776
1-[(E)-2-chloroethenyl]-4-[4-(ethoxymethyl)cyclohexyl]cyclohexane
CID 18656587
1-(2-fluoroethyl)-4-(4-propylcyclohexyl)cyclohexane
CID 18344046
1-[4-(2-fluoroethyl)cyclohexyl]-4-(4-propylcyclohexyl)cyclohexane
CID 18344057
2-(ethoxymethyl)oxirane;3-propylbicyclo[4.1.0]heptane
CID 159848161
2-[[4-(4-propylcyclohexyl)cyclohexyl]oxymethyl]oxirane
CID 58895347
bis[4-(4-propylcyclohexyl)cyclohexyl] carbonate
CID 70479427

Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane?
The IUPAC name of 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane (CID 19850412) is 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane.
What is the SMILES notation for 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane?
The canonical SMILES for 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane is CCCC1CCC(C2CCC(COCC)CC2)CC1.
What is the InChIKey of 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane?
The InChIKey is ZPNMWOXDKPZJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O/c1-3-5-15-6-10-17(11-7-15)18-12-8-16(9-13-18)14-19-4-2/h15-18H,3-14H2,1-2H3.
What are the key properties of 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane?
1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane has a molecular weight of 266.47 g/mol, XLogP of 5.44, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-4-(4-propylcyclohexyl)cyclohexane is sourced from PubChem (CID 19850412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).