1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol

C14H24N2O2 — CID 81058667

IUPAC1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
SMILESCC(C)OCCN(C)CC(O)c1ccccc1N
InChIInChI=1S/C14H24N2O2/c1-11(2)18-9-8-16(3)10-14(17)12-6-4-5-7-13(12)15/h4-7,11,14,17H,8-10,15H2,1-3H3
InChIKeyWMYSQRBJOLVGLL-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.66
Rot. Bonds7

About 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol

1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol (PubChem CID 81058667) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol.

Molecular Properties

Compound Name1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
PubChem CID81058667
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
SMILESCC(C)OCCN(C)CC(O)c1ccccc1N
InChIInChI=1S/C14H24N2O2/c1-11(2)18-9-8-16(3)10-14(17)12-6-4-5-7-13(12)15/h4-7,11,14,17H,8-10,15H2,1-3H3
InChIKeyWMYSQRBJOLVGLL-UHFFFAOYSA-N
XLogP1.66
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(2-aminophenyl)-2-[bis(2-methoxyethyl)amino]ethanol
CID 62264582
1-(2-aminophenyl)-2-[2-methoxyethyl(2-methylpropyl)amino]ethanol
CID 62265978
(2S)-1-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 103935283
1-(2-aminophenyl)-2-[(4-fluorophenyl)methyl-methylamino]ethanol
CID 62266116
2-[methyl(2-propan-2-yloxyethyl)amino]-1-(4-propylphenyl)ethanol
CID 81061903
2-(1-aminoethyl)-N-methyl-N-(2-propan-2-yloxyethyl)aniline
CID 81055890
1-(4-aminophenoxy)-3-[methyl(2-propan-2-yloxyethyl)amino]propan-2-ol
CID 81058463
2-[[2-(2-aminophenyl)-2-hydroxyethyl]-methylamino]-N-ethylacetamide
CID 62265975
1-(3,4-dimethoxyphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol
CID 81036228
1-(2-aminophenyl)-2-[3-(diethylamino)propyl-ethylamino]ethanol
CID 102991607
1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
CID 62266300
N'-hydroxy-3-[methyl(2-propan-2-yloxyethyl)amino]-2-phenylpropanimidamide
CID 81055319

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
The IUPAC name of 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol (CID 81058667) is 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol.
What is the SMILES notation for 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
The canonical SMILES for 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol is CC(C)OCCN(C)CC(O)c1ccccc1N.
What is the InChIKey of 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
The InChIKey is WMYSQRBJOLVGLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-11(2)18-9-8-16(3)10-14(17)12-6-4-5-7-13(12)15/h4-7,11,14,17H,8-10,15H2,1-3H3.
What are the key properties of 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol?
1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol has a molecular weight of 252.36 g/mol, XLogP of 1.66, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]ethanol is sourced from PubChem (CID 81058667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).