2-[2-(cyclohexylamino)ethoxy]ethanol

C10H21NO2 — CID 3361598

IUPAC2-[2-(cyclohexylamino)ethoxy]ethanol
SMILESOCCOCCNC1CCCCC1
InChIInChI=1S/C10H21NO2/c12-7-9-13-8-6-11-10-4-2-1-3-5-10/h10-12H,1-9H2
InChIKeyCLJNCVKWWHCWGC-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.92
Rot. Bonds6

About 2-[2-(cyclohexylamino)ethoxy]ethanol

2-[2-(cyclohexylamino)ethoxy]ethanol (PubChem CID 3361598) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-[2-(cyclohexylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(cyclohexylamino)ethoxy]ethanol
PubChem CID3361598
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-[2-(cyclohexylamino)ethoxy]ethanol
SMILESOCCOCCNC1CCCCC1
InChIInChI=1S/C10H21NO2/c12-7-9-13-8-6-11-10-4-2-1-3-5-10/h10-12H,1-9H2
InChIKeyCLJNCVKWWHCWGC-UHFFFAOYSA-N
XLogP0.92
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclohexylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(cyclohexylamino)ethoxy]ethanol (CID 3361598) is 2-[2-(cyclohexylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(cyclohexylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(cyclohexylamino)ethoxy]ethanol is OCCOCCNC1CCCCC1.
What is the InChIKey of 2-[2-(cyclohexylamino)ethoxy]ethanol?
The InChIKey is CLJNCVKWWHCWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c12-7-9-13-8-6-11-10-4-2-1-3-5-10/h10-12H,1-9H2.
What are the key properties of 2-[2-(cyclohexylamino)ethoxy]ethanol?
2-[2-(cyclohexylamino)ethoxy]ethanol has a molecular weight of 187.28 g/mol, XLogP of 0.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclohexylamino)ethoxy]ethanol is sourced from PubChem (CID 3361598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).