2-(4-amino-2-ethylanilino)ethanol

C10H16N2O — CID 54391550

IUPAC2-(4-amino-2-ethylanilino)ethanol
SMILESCCc1cc(N)ccc1NCCO
InChIInChI=1S/C10H16N2O/c1-2-8-7-9(11)3-4-10(8)12-5-6-13/h3-4,7,12-13H,2,5-6,11H2,1H3
InChIKeyVGZRSINUDFULCY-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.24
Rot. Bonds4

About 2-(4-amino-2-ethylanilino)ethanol

2-(4-amino-2-ethylanilino)ethanol (PubChem CID 54391550) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-(4-amino-2-ethylanilino)ethanol.

Molecular Properties

Compound Name2-(4-amino-2-ethylanilino)ethanol
PubChem CID54391550
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-(4-amino-2-ethylanilino)ethanol
SMILESCCc1cc(N)ccc1NCCO
InChIInChI=1S/C10H16N2O/c1-2-8-7-9(11)3-4-10(8)12-5-6-13/h3-4,7,12-13H,2,5-6,11H2,1H3
InChIKeyVGZRSINUDFULCY-UHFFFAOYSA-N
XLogP1.24
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[4-amino-2-(hydroxymethyl)anilino]ethanol
CID 163969372
2-(4-amino-2-methylanilino)ethanol;hydrate
CID 70505046
2-(4-amino-2-chloroanilino)ethanol;sulfuric acid
CID 70564055
5-amino-2-(2-hydroxyethylamino)benzonitrile
CID 15827829
2-[4-amino-2-(4-trimethylsilylphenyl)anilino]ethanol
CID 18371603
1-[5-amino-2-(2-hydroxyethylamino)phenyl]-2-[2-[5-amino-2-(2-hydroxyethylamino)phenyl]-2-hydroxyethyl]sulfonylethanol
CID 67739694
2-[4-amino-2-(4-chlorophenyl)anilino]ethanol
CID 18371506
5-[5-amino-2-(2-hydroxyethylamino)phenyl]benzene-1,3-diol
CID 18371667
2-(4-amino-2-methylanilino)-N-(2-hydroxyethyl)ethanesulfonamide
CID 58586704
3-amino-5-[5-amino-2-(2-hydroxyethylamino)phenyl]phenol
CID 18371925
3-ethyl-4-methylaniline;hydrochloride
CID 23499109
6-amino-4-(2-hydroxyethylamino)-1-methylquinolin-2-one
CID 142478323

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2-ethylanilino)ethanol?
The IUPAC name of 2-(4-amino-2-ethylanilino)ethanol (CID 54391550) is 2-(4-amino-2-ethylanilino)ethanol.
What is the SMILES notation for 2-(4-amino-2-ethylanilino)ethanol?
The canonical SMILES for 2-(4-amino-2-ethylanilino)ethanol is CCc1cc(N)ccc1NCCO.
What is the InChIKey of 2-(4-amino-2-ethylanilino)ethanol?
The InChIKey is VGZRSINUDFULCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-8-7-9(11)3-4-10(8)12-5-6-13/h3-4,7,12-13H,2,5-6,11H2,1H3.
What are the key properties of 2-(4-amino-2-ethylanilino)ethanol?
2-(4-amino-2-ethylanilino)ethanol has a molecular weight of 180.25 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2-ethylanilino)ethanol is sourced from PubChem (CID 54391550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).