2-[2-amino-5-(dimethylamino)phenoxy]ethanol

C10H16N2O2 — CID 79589167

IUPAC2-[2-amino-5-(dimethylamino)phenoxy]ethanol
SMILESCN(C)c1ccc(N)c(OCCO)c1
InChIInChI=1S/C10H16N2O2/c1-12(2)8-3-4-9(11)10(7-8)14-6-5-13/h3-4,7,13H,5-6,11H2,1-2H3
InChIKeyRXYGIEIBYOLMLJ-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.71
Rot. Bonds4

About 2-[2-amino-5-(dimethylamino)phenoxy]ethanol

2-[2-amino-5-(dimethylamino)phenoxy]ethanol (PubChem CID 79589167) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[2-amino-5-(dimethylamino)phenoxy]ethanol.

Molecular Properties

Compound Name2-[2-amino-5-(dimethylamino)phenoxy]ethanol
PubChem CID79589167
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-[2-amino-5-(dimethylamino)phenoxy]ethanol
SMILESCN(C)c1ccc(N)c(OCCO)c1
InChIInChI=1S/C10H16N2O2/c1-12(2)8-3-4-9(11)10(7-8)14-6-5-13/h3-4,7,13H,5-6,11H2,1-2H3
InChIKeyRXYGIEIBYOLMLJ-UHFFFAOYSA-N
XLogP0.71
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-[2-amino-5-(dimethylamino)phenoxy]propan-1-ol
CID 79588900
4-[2-amino-5-(dimethylamino)phenoxy]-2-methylbutan-2-ol
CID 79588662
2-[2,5-diamino-4-(2-hydroxyethoxy)phenoxy]ethanol;prop-1-en-2-amine;4-N,4-N,2-trimethylbenzene-1,4-diamine
CID 171502663
4-N,4-N-dimethyl-2-(3-methylbutoxy)benzene-1,4-diamine
CID 79588986
4-N,4-N-dimethyl-2-(3-phenylpropoxy)benzene-1,4-diamine
CID 79588899
4-N,4-N-dimethyl-2-[2-(trifluoromethylsulfanyl)ethoxy]benzene-1,4-diamine
CID 116614847
2-(2,2-difluoroethoxy)-4-N,4-N-dimethylbenzene-1,4-diamine
CID 79588821
4-N,4-N-dimethyl-2-(2-propylsulfonylethoxy)benzene-1,4-diamine
CID 106721717
3-[2-amino-5-(dimethylamino)phenoxy]-N-cyclopropylpropanamide
CID 79589419
2-[(4-ethylphenyl)methoxy]-4-N,4-N-dimethylbenzene-1,4-diamine
CID 79589331
2-(4-amino-N-ethyl-3-propoxyanilino)ethanol
CID 63670341
4-amino-3-(2-hydroxyethoxy)benzoic acid
CID 43379927

Frequently Asked Questions

What is the IUPAC name of 2-[2-amino-5-(dimethylamino)phenoxy]ethanol?
The IUPAC name of 2-[2-amino-5-(dimethylamino)phenoxy]ethanol (CID 79589167) is 2-[2-amino-5-(dimethylamino)phenoxy]ethanol.
What is the SMILES notation for 2-[2-amino-5-(dimethylamino)phenoxy]ethanol?
The canonical SMILES for 2-[2-amino-5-(dimethylamino)phenoxy]ethanol is CN(C)c1ccc(N)c(OCCO)c1.
What is the InChIKey of 2-[2-amino-5-(dimethylamino)phenoxy]ethanol?
The InChIKey is RXYGIEIBYOLMLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-12(2)8-3-4-9(11)10(7-8)14-6-5-13/h3-4,7,13H,5-6,11H2,1-2H3.
What are the key properties of 2-[2-amino-5-(dimethylamino)phenoxy]ethanol?
2-[2-amino-5-(dimethylamino)phenoxy]ethanol has a molecular weight of 196.25 g/mol, XLogP of 0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-amino-5-(dimethylamino)phenoxy]ethanol is sourced from PubChem (CID 79589167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).