1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol

C18H34O — CID 139648654

IUPAC1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol
SMILESCCC1CCC(CCC2CCC(O)(CC)CC2)CC1
InChIInChI=1S/C18H34O/c1-3-15-5-7-16(8-6-15)9-10-17-11-13-18(19,4-2)14-12-17/h15-17,19H,3-14H2,1-2H3
InChIKeyPDKBHBVSTXIGSK-UHFFFAOYSA-N
MW266.47 g/mol
LogP5.31
Rot. Bonds5

About 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol

1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol (PubChem CID 139648654) has the molecular formula C18H34O and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol
PubChem CID139648654
Molecular FormulaC18H34O
Molecular Weight266.47 g/mol
Exact Mass266.26
IUPAC Name1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol
SMILESCCC1CCC(CCC2CCC(O)(CC)CC2)CC1
InChIInChI=1S/C18H34O/c1-3-15-5-7-16(8-6-15)9-10-17-11-13-18(19,4-2)14-12-17/h15-17,19H,3-14H2,1-2H3
InChIKeyPDKBHBVSTXIGSK-UHFFFAOYSA-N
XLogP5.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.47
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-ethyl-1-[[(4-ethylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 65116333
4-tert-butyl-1-ethylcyclohexan-1-ol
CID 12709682
4-ethyl-1-(ethylaminomethyl)cyclohexan-1-ol
CID 62773711
4-ethyl-1-(hydroxymethyl)cycloheptan-1-ol
CID 82713966
1-(1-hydroxy-4-propylcyclohexyl)-4-propylcyclohexan-1-ol
CID 70888853
1-ethyl-4-(trifluoromethyl)cyclohexan-1-ol
CID 64756511
4-ethyl-1-(2-methylbutyl)cyclohexan-1-ol
CID 65147481
1-decyl-4-ethylcyclohexan-1-ol
CID 65147378
1-(2-aminoethyl)-4-propylcyclohexan-1-ol
CID 79128310
1-(4-ethylcyclohexyl)-4-propylcyclohexan-1-amine
CID 64750303
1-(propan-2-yloxymethyl)-4-propylcyclohexan-1-ol
CID 79568462
N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-methylpropane-2-sulfonamide
CID 65121313

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol?
The IUPAC name of 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol (CID 139648654) is 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol.
What is the SMILES notation for 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol?
The canonical SMILES for 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol is CCC1CCC(CCC2CCC(O)(CC)CC2)CC1.
What is the InChIKey of 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol?
The InChIKey is PDKBHBVSTXIGSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O/c1-3-15-5-7-16(8-6-15)9-10-17-11-13-18(19,4-2)14-12-17/h15-17,19H,3-14H2,1-2H3.
What are the key properties of 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol?
1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol has a molecular weight of 266.47 g/mol, XLogP of 5.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol is sourced from PubChem (CID 139648654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).