1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol

C12H20N2O2 — CID 62266300

IUPAC1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
SMILESCCN(CCO)CC(O)c1ccccc1N
InChIInChI=1S/C12H20N2O2/c1-2-14(7-8-15)9-12(16)10-5-3-4-6-11(10)13/h3-6,12,15-16H,2,7-9,13H2,1H3
InChIKeyOTPYNJXWQFTTQI-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.62
Rot. Bonds6

About 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol

1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol (PubChem CID 62266300) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
PubChem CID62266300
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
SMILESCCN(CCO)CC(O)c1ccccc1N
InChIInChI=1S/C12H20N2O2/c1-2-14(7-8-15)9-12(16)10-5-3-4-6-11(10)13/h3-6,12,15-16H,2,7-9,13H2,1H3
InChIKeyOTPYNJXWQFTTQI-UHFFFAOYSA-N
XLogP0.62
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.62
H-Bond Donors ≤ 53
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-[3-(diethylamino)propyl-ethylamino]ethanol
CID 102991607
1-(2-aminophenyl)-2-[butyl(ethyl)amino]ethanol
CID 62264739
3-[[2-(2-aminophenyl)-2-hydroxyethyl]-ethylamino]propanenitrile
CID 62266148
1-(2-aminophenyl)-2-[bis(2-methoxyethyl)amino]ethanol
CID 62264582
1-(2-aminophenyl)-3-[butyl(ethyl)amino]propan-1-ol
CID 82071642
1-(2-aminophenyl)-2-[2-methoxyethyl(2-methylpropyl)amino]ethanol
CID 62265978
1-(2-fluorophenyl)-2-[2-hydroxyethyl(propyl)amino]ethanol
CID 56811844
1-(2,5-difluorophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol
CID 82217059
1-(2-aminophenyl)-3-(dibutylamino)propan-1-ol
CID 82071441
2-[ethyl(2-hydroxyethyl)amino]-1-(4-fluorophenyl)ethanol
CID 82215871
2-[[3-amino-3-(2-fluorophenyl)-2-methylpropyl]-ethylamino]ethanol
CID 112679850
1-(2-aminophenyl)-3-[ethyl(2-pyridin-4-ylethyl)amino]propan-1-ol
CID 82071464

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol (CID 62266300) is 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol is CCN(CCO)CC(O)c1ccccc1N.
What is the InChIKey of 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol?
The InChIKey is OTPYNJXWQFTTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-2-14(7-8-15)9-12(16)10-5-3-4-6-11(10)13/h3-6,12,15-16H,2,7-9,13H2,1H3.
What are the key properties of 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol?
1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol has a molecular weight of 224.30 g/mol, XLogP of 0.62, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)-2-[ethyl(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 62266300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).