1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol

C14H28O3 — CID 104753771

IUPAC1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol
SMILESCC(C)(C)OCCOCC(O)C1CCCCC1
InChIInChI=1S/C14H28O3/c1-14(2,3)17-10-9-16-11-13(15)12-7-5-4-6-8-12/h12-13,15H,4-11H2,1-3H3
InChIKeyUKDZIVDGANSRFD-UHFFFAOYSA-N
MW244.37 g/mol
LogP2.76
Rot. Bonds6

About 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol

1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol (PubChem CID 104753771) has the molecular formula C14H28O3 and a molecular weight of 244.37 g/mol. Its IUPAC name is 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol
PubChem CID104753771
Molecular FormulaC14H28O3
Molecular Weight244.37 g/mol
Exact Mass244.20
IUPAC Name1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol
SMILESCC(C)(C)OCCOCC(O)C1CCCCC1
InChIInChI=1S/C14H28O3/c1-14(2,3)17-10-9-16-11-13(15)12-7-5-4-6-8-12/h12-13,15H,4-11H2,1-3H3
InChIKeyUKDZIVDGANSRFD-UHFFFAOYSA-N
XLogP2.76
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-cyclopentyl-2-(3,3,3-trifluoropropoxy)ethanol
CID 104753766
2-(cyclopropylamino)-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propan-1-ol
CID 112590416
1-cyclohexyl-2-(cyclopentylmethoxy)ethanol
CID 104753739
1-(4-methylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105102501
N-[3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]cyclohexanamine
CID 112590092
1-(4-ethylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105103646
2-cycloheptyloxy-1-cyclopentylethanol
CID 104753667
(2S)-1-cyclopentyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 157185666
2-cyclopentyl-4-[(2-methylpropan-2-yl)oxy]butanoic acid
CID 112590816
2-methyl-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 134597159
(2S)-1-(cyclohexylamino)-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 8741576
2-propoxy-1-[4-(trifluoromethyl)cyclohexyl]ethanol
CID 105112009

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol?
The IUPAC name of 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol (CID 104753771) is 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol.
What is the SMILES notation for 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol?
The canonical SMILES for 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol is CC(C)(C)OCCOCC(O)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol?
The InChIKey is UKDZIVDGANSRFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3/c1-14(2,3)17-10-9-16-11-13(15)12-7-5-4-6-8-12/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol?
1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol has a molecular weight of 244.37 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethanol is sourced from PubChem (CID 104753771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).