2-amino-1-[3-(diethylamino)phenyl]ethanol

C12H20N2O — CID 117297990

IUPAC2-amino-1-[3-(diethylamino)phenyl]ethanol
SMILESCCN(CC)c1cccc(C(O)CN)c1
InChIInChI=1S/C12H20N2O/c1-3-14(4-2)11-7-5-6-10(8-11)12(15)9-13/h5-8,12,15H,3-4,9,13H2,1-2H3
InChIKeyFGJDBIQDRLQYON-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.52
Rot. Bonds5

About 2-amino-1-[3-(diethylamino)phenyl]ethanol

2-amino-1-[3-(diethylamino)phenyl]ethanol (PubChem CID 117297990) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-amino-1-[3-(diethylamino)phenyl]ethanol.

Molecular Properties

Compound Name2-amino-1-[3-(diethylamino)phenyl]ethanol
PubChem CID117297990
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-amino-1-[3-(diethylamino)phenyl]ethanol
SMILESCCN(CC)c1cccc(C(O)CN)c1
InChIInChI=1S/C12H20N2O/c1-3-14(4-2)11-7-5-6-10(8-11)12(15)9-13/h5-8,12,15H,3-4,9,13H2,1-2H3
InChIKeyFGJDBIQDRLQYON-UHFFFAOYSA-N
XLogP1.52
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-aminopropan-2-yl)-N,N-diethylaniline
CID 117295299
1-[3-(diethylamino)phenyl]-2-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)ethanol
CID 162347694
3-[1-[3-(diethylamino)phenyl]propyl]-N,N-diethylaniline
CID 70890902
1-[3-(diethylamino)phenyl]-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-1-ol
CID 156763304
3-amino-1-[3-(dimethylamino)phenyl]propan-1-ol
CID 82605939
2-amino-1-[3-(trifluoromethyl)phenyl]ethanol
CID 30514
2-amino-1-[3-(1,1-difluoro-2-methylpropyl)phenyl]ethanol
CID 116992716
2-amino-1-[3-(4-methylphenyl)phenyl]ethanol
CID 82287999
2-amino-1-phenylethanol;ethane
CID 91425169
3-(2-aminoethyl)-N,N-diethylaniline
CID 82402430
2-(N-ethyl-3-methylanilino)-1-pyridin-3-ylethanol
CID 82216494
2-amino-1-[3-(1,1-difluoro-3-methylbutyl)phenyl]ethanol
CID 116993040

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[3-(diethylamino)phenyl]ethanol?
The IUPAC name of 2-amino-1-[3-(diethylamino)phenyl]ethanol (CID 117297990) is 2-amino-1-[3-(diethylamino)phenyl]ethanol.
What is the SMILES notation for 2-amino-1-[3-(diethylamino)phenyl]ethanol?
The canonical SMILES for 2-amino-1-[3-(diethylamino)phenyl]ethanol is CCN(CC)c1cccc(C(O)CN)c1.
What is the InChIKey of 2-amino-1-[3-(diethylamino)phenyl]ethanol?
The InChIKey is FGJDBIQDRLQYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-3-14(4-2)11-7-5-6-10(8-11)12(15)9-13/h5-8,12,15H,3-4,9,13H2,1-2H3.
What are the key properties of 2-amino-1-[3-(diethylamino)phenyl]ethanol?
2-amino-1-[3-(diethylamino)phenyl]ethanol has a molecular weight of 208.30 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[3-(diethylamino)phenyl]ethanol is sourced from PubChem (CID 117297990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).