2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol

C14H23NO2S — CID 63827685

IUPAC2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol
SMILESOC(CNCCOC1CCCCC1)c1cccs1
InChIInChI=1S/C14H23NO2S/c16-13(14-7-4-10-18-14)11-15-8-9-17-12-5-2-1-3-6-12/h4,7,10,12-13,15-16H,1-3,5-6,8-9,11H2
InChIKeyHUAJCVYYWBAGSK-UHFFFAOYSA-N
MW269.41 g/mol
LogP2.72
Rot. Bonds7

About 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol

2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol (PubChem CID 63827685) has the molecular formula C14H23NO2S and a molecular weight of 269.41 g/mol. Its IUPAC name is 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol
PubChem CID63827685
Molecular FormulaC14H23NO2S
Molecular Weight269.41 g/mol
Exact Mass269.14
IUPAC Name2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol
SMILESOC(CNCCOC1CCCCC1)c1cccs1
InChIInChI=1S/C14H23NO2S/c16-13(14-7-4-10-18-14)11-15-8-9-17-12-5-2-1-3-6-12/h4,7,10,12-13,15-16H,1-3,5-6,8-9,11H2
InChIKeyHUAJCVYYWBAGSK-UHFFFAOYSA-N
XLogP2.72
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-cyclohexyloxyethylamino)-1-phenylethanol
CID 55259175
N-(2-cyclopentyloxyethyl)-2-methyl-1-thiophen-2-ylpropan-1-amine
CID 55262215
2-[2-(oxan-2-yl)ethylamino]-1-thiophen-2-ylethanol
CID 114135927
1-cyclopropyl-2-[(2-hydroxy-2-thiophen-2-ylethyl)amino]ethanol
CID 63296586
2-(2-piperidin-1-ylethylamino)-1-thiophen-2-ylethanol
CID 60970344
(1R)-2-(propylamino)-1-thiophen-2-ylethanol
CID 39237770
2-[2-(2-methylprop-2-enoxy)ethylamino]-1-thiophen-2-ylethanol
CID 114467683
1-[(2R)-2-hydroxy-2-thiophen-2-ylethyl]-3-[2-[(1S,2R)-2-methylcyclohexyl]oxyethyl]urea
CID 99846608
N-(3-cyclopentyloxypropyl)-4-[hydroxy(thiophen-2-yl)methyl]piperidine-1-carboxamide
CID 122556169
N-[2-[(2-hydroxy-2-thiophen-2-ylethyl)amino]ethyl]cyclopropanecarboxamide
CID 113227942
2-[(2-propan-2-ylcyclohexyl)amino]-1-thiophen-2-ylethanol
CID 81339661
1-cyclopentyloxy-3-(2-cyclopentyloxyethylamino)propan-2-ol
CID 63827682

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol?
The IUPAC name of 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol (CID 63827685) is 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol.
What is the SMILES notation for 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol?
The canonical SMILES for 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol is OC(CNCCOC1CCCCC1)c1cccs1.
What is the InChIKey of 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol?
The InChIKey is HUAJCVYYWBAGSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2S/c16-13(14-7-4-10-18-14)11-15-8-9-17-12-5-2-1-3-6-12/h4,7,10,12-13,15-16H,1-3,5-6,8-9,11H2.
What are the key properties of 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol?
2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol has a molecular weight of 269.41 g/mol, XLogP of 2.72, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexyloxyethylamino)-1-thiophen-2-ylethanol is sourced from PubChem (CID 63827685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).