2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol

C10H17NO2S — CID 82724870

IUPAC2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol
SMILESCC(C)(C)ONCC(O)c1cccs1
InChIInChI=1S/C10H17NO2S/c1-10(2,3)13-11-7-8(12)9-5-4-6-14-9/h4-6,8,11-12H,7H2,1-3H3
InChIKeyDDGLICUSODPTQZ-UHFFFAOYSA-N
MW215.32 g/mol
LogP2.10
Rot. Bonds4

About 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol

2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol (PubChem CID 82724870) has the molecular formula C10H17NO2S and a molecular weight of 215.32 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol
PubChem CID82724870
Molecular FormulaC10H17NO2S
Molecular Weight215.32 g/mol
Exact Mass215.10
IUPAC Name2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol
SMILESCC(C)(C)ONCC(O)c1cccs1
InChIInChI=1S/C10H17NO2S/c1-10(2,3)13-11-7-8(12)9-5-4-6-14-9/h4-6,8,11-12H,7H2,1-3H3
InChIKeyDDGLICUSODPTQZ-UHFFFAOYSA-N
XLogP2.10
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

tert-butyl N-[(2S)-2-hydroxy-2-thiophen-2-ylethyl]carbamate
CID 12071428
2-(methylamino)-1-thiophen-2-ylethanol
CID 22498745
2-(3,3-dimethylbutylamino)-1-thiophen-2-ylethanol
CID 115581040
(1R)-2-(propylamino)-1-thiophen-2-ylethanol
CID 39237770
N-[(2-methylpropan-2-yl)oxy]-1-thiophen-2-ylethanamine
CID 82720685
2-(4-methoxy-2-methylanilino)-1-thiophen-2-ylethanol
CID 62871696
2-(2-ethylbutylamino)-1-thiophen-2-ylethanol
CID 115756931
N-tert-butyl-2-[(2-hydroxy-2-thiophen-2-ylethyl)amino]acetamide
CID 113293230
2-[2-(2-methylprop-2-enoxy)ethylamino]-1-thiophen-2-ylethanol
CID 114467683
2-[(2-hydroxy-2-thiophen-2-ylethyl)amino]propane-1,3-diol
CID 65314705
2-(2-propan-2-ylanilino)-1-thiophen-2-ylethanol
CID 60896734
4-methoxy-4-methyl-1-thiophen-2-ylpentan-1-ol
CID 103028394

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol (CID 82724870) is 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol is CC(C)(C)ONCC(O)c1cccs1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol?
The InChIKey is DDGLICUSODPTQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2S/c1-10(2,3)13-11-7-8(12)9-5-4-6-14-9/h4-6,8,11-12H,7H2,1-3H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol?
2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol has a molecular weight of 215.32 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxyamino]-1-thiophen-2-ylethanol is sourced from PubChem (CID 82724870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).