1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol

C17H18N2O — CID 19094093

IUPAC1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol
SMILESCC(O)C1=CC(N)c2ccccc2N1c1ccccc1
InChIInChI=1S/C17H18N2O/c1-12(20)17-11-15(18)14-9-5-6-10-16(14)19(17)13-7-3-2-4-8-13/h2-12,15,20H,18H2,1H3
InChIKeyLTMUGPPVUZWENB-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.10
Rot. Bonds2

About 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol

1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol (PubChem CID 19094093) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol.

Molecular Properties

Compound Name1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol
PubChem CID19094093
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol
SMILESCC(O)C1=CC(N)c2ccccc2N1c1ccccc1
InChIInChI=1S/C17H18N2O/c1-12(20)17-11-15(18)14-9-5-6-10-16(14)19(17)13-7-3-2-4-8-13/h2-12,15,20H,18H2,1H3
InChIKeyLTMUGPPVUZWENB-UHFFFAOYSA-N
XLogP3.10
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(R,S/S,R)-syn-1-(methyl(phenyl)amino)-3-(methylamino)-1-phenylpropan-2-ol
CID 24897268
(1S,2R)-1-(methyl(o-tolyl)amino)-3-(methylamino)-1-phenylpropan-2-ol
CID 24897269
(R,S/S,R)-syn-3-amino-1-(methyl(phenyl)amino)-1-phenylpropan-2-ol
CID 24897032
(2R)-1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-3-(methylamino)propan-2-ol
CID 44422453
(1R,2R)-3-(methylamino)-1-(N-methylanilino)-1-phenylpropan-2-ol
CID 44574884
1-[5-(benzylamino)-3,4-dihydro-1H-isoquinolin-2-yl]-3-(methylamino)propan-2-ol
CID 155549658
2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((2-(1-methylethyl)phenyl)amino)-
CID 3062649
1-Piperazineethanol, 4-(diphenylmethyl)-alpha-((phenylamino)methyl)-
CID 3072696
1-(1,2,3,4,4a,9a-Hexahydrocarbazol-9-yl)-3-(methylamino)propan-2-ol
CID 57402933
1-(5-anilino-3,4-dihydro-1H-isoquinolin-2-yl)-3-(methylamino)propan-2-ol
CID 155568483
US10233152, Example 3
CID 129279606
US10233152, Example 4
CID 129279700

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol?
The IUPAC name of 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol (CID 19094093) is 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol.
What is the SMILES notation for 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol?
The canonical SMILES for 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol is CC(O)C1=CC(N)c2ccccc2N1c1ccccc1.
What is the InChIKey of 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol?
The InChIKey is LTMUGPPVUZWENB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-12(20)17-11-15(18)14-9-5-6-10-16(14)19(17)13-7-3-2-4-8-13/h2-12,15,20H,18H2,1H3.
What are the key properties of 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol?
1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol has a molecular weight of 266.34 g/mol, XLogP of 3.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-1-phenyl-4H-quinolin-2-yl)ethanol is sourced from PubChem (CID 19094093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).