2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol

C15H22O4 — CID 175529809

IUPAC2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol
SMILESOCCO[C@@H](Oc1ccccc1)OC1CCCCC1
InChIInChI=1S/C15H22O4/c16-11-12-17-15(18-13-7-3-1-4-8-13)19-14-9-5-2-6-10-14/h1,3-4,7-8,14-16H,2,5-6,9-12H2/t15-/m0/s1
InChIKeyFRRDXTZWZGSZMG-HNNXBMFYSA-N
MW266.34 g/mol
LogP2.71
Rot. Bonds7

About 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol

2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol (PubChem CID 175529809) has the molecular formula C15H22O4 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol.

Molecular Properties

Compound Name2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol
PubChem CID175529809
Molecular FormulaC15H22O4
Molecular Weight266.34 g/mol
Exact Mass266.15
IUPAC Name2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol
SMILESOCCO[C@@H](Oc1ccccc1)OC1CCCCC1
InChIInChI=1S/C15H22O4/c16-11-12-17-15(18-13-7-3-1-4-8-13)19-14-9-5-2-6-10-14/h1,3-4,7-8,14-16H,2,5-6,9-12H2/t15-/m0/s1
InChIKeyFRRDXTZWZGSZMG-HNNXBMFYSA-N
XLogP2.71
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol?
The IUPAC name of 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol (CID 175529809) is 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol.
What is the SMILES notation for 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol?
The canonical SMILES for 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol is OCCO[C@@H](Oc1ccccc1)OC1CCCCC1.
What is the InChIKey of 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol?
The InChIKey is FRRDXTZWZGSZMG-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H22O4/c16-11-12-17-15(18-13-7-3-1-4-8-13)19-14-9-5-2-6-10-14/h1,3-4,7-8,14-16H,2,5-6,9-12H2/t15-/m0/s1.
What are the key properties of 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol?
2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol has a molecular weight of 266.34 g/mol, XLogP of 2.71, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(R)-cyclohexyloxy(phenoxy)methoxy]ethanol is sourced from PubChem (CID 175529809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).