1-(4-amino-7-fluoroquinolin-3-yl)ethanol

C11H11FN2O — CID 123249660

IUPAC1-(4-amino-7-fluoroquinolin-3-yl)ethanol
SMILESCC(O)c1cnc2cc(F)ccc2c1N
InChIInChI=1S/C11H11FN2O/c1-6(15)9-5-14-10-4-7(12)2-3-8(10)11(9)13/h2-6,15H,1H3,(H2,13,14)
InChIKeyQXUYSMODCHOHBC-UHFFFAOYSA-N
MW206.22 g/mol
LogP2.01
Rot. Bonds1

About 1-(4-amino-7-fluoroquinolin-3-yl)ethanol

1-(4-amino-7-fluoroquinolin-3-yl)ethanol (PubChem CID 123249660) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is 1-(4-amino-7-fluoroquinolin-3-yl)ethanol.

Molecular Properties

Compound Name1-(4-amino-7-fluoroquinolin-3-yl)ethanol
PubChem CID123249660
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC Name1-(4-amino-7-fluoroquinolin-3-yl)ethanol
SMILESCC(O)c1cnc2cc(F)ccc2c1N
InChIInChI=1S/C11H11FN2O/c1-6(15)9-5-14-10-4-7(12)2-3-8(10)11(9)13/h2-6,15H,1H3,(H2,13,14)
InChIKeyQXUYSMODCHOHBC-UHFFFAOYSA-N
XLogP2.01
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-fluoro-3-propan-2-ylquinolin-4-yl)-2,5-dihydro-1λ5-phosphole 1-oxide
CID 171446485
4-fluoro-2-(1-hydroxyethyl)phenol
CID 53406163
5-fluoro-2-[3-(1-hydroxyethyl)-4-pyridinyl]phenol
CID 142640618
(1S)-1-(5-fluoro-2-methylsulfanylphenyl)ethanol
CID 78951625
1-(5-fluoro-1-methylindol-3-yl)ethanol
CID 117121009
3-chloro-7-fluoro-2-methylquinolin-4-amine
CID 121236696
N-(4-amino-7-fluoroquinolin-3-yl)-1,2-oxazole-3-carboxamide
CID 10635873
(1S)-1-amino-1-(2-amino-4-fluorophenyl)propan-2-ol
CID 130707231
1-(2-amino-4-fluorophenyl)-2,2-dimethylpropan-1-ol
CID 105450766
(1R)-1-(5-fluoro-2-quinolin-3-yloxyphenyl)ethanol
CID 107387519
(4-amino-6-fluoroquinolin-3-yl)methanol
CID 115018882
6-fluoro-4-propan-2-ylquinolin-3-ol
CID 105457227

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-7-fluoroquinolin-3-yl)ethanol?
The IUPAC name of 1-(4-amino-7-fluoroquinolin-3-yl)ethanol (CID 123249660) is 1-(4-amino-7-fluoroquinolin-3-yl)ethanol.
What is the SMILES notation for 1-(4-amino-7-fluoroquinolin-3-yl)ethanol?
The canonical SMILES for 1-(4-amino-7-fluoroquinolin-3-yl)ethanol is CC(O)c1cnc2cc(F)ccc2c1N.
What is the InChIKey of 1-(4-amino-7-fluoroquinolin-3-yl)ethanol?
The InChIKey is QXUYSMODCHOHBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-6(15)9-5-14-10-4-7(12)2-3-8(10)11(9)13/h2-6,15H,1H3,(H2,13,14).
What are the key properties of 1-(4-amino-7-fluoroquinolin-3-yl)ethanol?
1-(4-amino-7-fluoroquinolin-3-yl)ethanol has a molecular weight of 206.22 g/mol, XLogP of 2.01, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-7-fluoroquinolin-3-yl)ethanol is sourced from PubChem (CID 123249660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).