1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine

C13H27NO2 — CID 104748657

IUPAC1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine
SMILESCCNC(COCCOC)C1CCCCC1
InChIInChI=1S/C13H27NO2/c1-3-14-13(11-16-10-9-15-2)12-7-5-4-6-8-12/h12-14H,3-11H2,1-2H3
InChIKeyDUQMBRSHHWLWOA-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.21
Rot. Bonds8

About 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine

1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine (PubChem CID 104748657) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine
PubChem CID104748657
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine
SMILESCCNC(COCCOC)C1CCCCC1
InChIInChI=1S/C13H27NO2/c1-3-14-13(11-16-10-9-15-2)12-7-5-4-6-8-12/h12-14H,3-11H2,1-2H3
InChIKeyDUQMBRSHHWLWOA-UHFFFAOYSA-N
XLogP2.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.21
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-cycloheptyl-N-ethyl-2-methoxyethanamine
CID 79574660
1-cyclohexyl-N-ethyl-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106447381
2-butoxy-1-cyclopentyl-N-ethylethanamine
CID 104749090
N-[1-cyclopropyl-2-[2-(2-methoxyethoxy)ethoxy]ethyl]propan-1-amine
CID 104560815
1-cyclohexyl-N-ethyl-N'-(3-methoxypropyl)-N'-methylethane-1,2-diamine
CID 113448229
N-[1-cyclopentyl-2-(2-propoxyethoxy)ethyl]propan-1-amine
CID 104749456
1-cyclopentyl-N-ethyl-6-methoxyhexan-1-amine
CID 104648397
1-cyclopentyl-N-ethyl-2-propan-2-yloxyethanamine
CID 79574827
1-cycloheptyl-3-(2-methoxyethoxy)-N-methylpropan-1-amine
CID 102928168
1-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-(2-methoxyethoxy)ethanamine
CID 114246670
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
1-cyclohexyl-2-(2-methoxyethoxy)ethanamine
CID 104748661

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine?
The IUPAC name of 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine (CID 104748657) is 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine.
What is the SMILES notation for 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine?
The canonical SMILES for 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine is CCNC(COCCOC)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine?
The InChIKey is DUQMBRSHHWLWOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-3-14-13(11-16-10-9-15-2)12-7-5-4-6-8-12/h12-14H,3-11H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine?
1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine has a molecular weight of 229.36 g/mol, XLogP of 2.21, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethyl-2-(2-methoxyethoxy)ethanamine is sourced from PubChem (CID 104748657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).