6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride

C12H13ClFNO — CID 171221161

IUPAC6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride
SMILESCl.N[C@@H](CF)c1ccc2cc(O)ccc2c1
InChIInChI=1S/C12H12FNO.ClH/c13-7-12(14)10-2-1-9-6-11(15)4-3-8(9)5-10;/h1-6,12,15H,7,14H2;1H/t12-;/m0./s1
InChIKeyZPXGDPMRCSJKKD-YDALLXLXSA-N
MW241.69 g/mol
LogP2.94
Rot. Bonds2

About 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride

6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride (PubChem CID 171221161) has the molecular formula C12H13ClFNO and a molecular weight of 241.69 g/mol. Its IUPAC name is 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride.

Molecular Properties

Compound Name6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride
PubChem CID171221161
Molecular FormulaC12H13ClFNO
Molecular Weight241.69 g/mol
Exact Mass241.07
IUPAC Name6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride
SMILESCl.N[C@@H](CF)c1ccc2cc(O)ccc2c1
InChIInChI=1S/C12H12FNO.ClH/c13-7-12(14)10-2-1-9-6-11(15)4-3-8(9)5-10;/h1-6,12,15H,7,14H2;1H/t12-;/m0./s1
InChIKeyZPXGDPMRCSJKKD-YDALLXLXSA-N
XLogP2.94
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.69
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(1R)-1-amino-4-hydroxybutyl]naphthalen-2-ol;hydrochloride
CID 171201678
6-[(1S)-1-amino-4-hydroxybutyl]naphthalen-2-ol;hydrochloride
CID 171221215
6-[(1R)-1-amino-3-hydroxypropyl]naphthalen-2-ol
CID 131323903
6-[(1R)-1-amino-3-methylbut-3-enyl]naphthalen-2-ol;hydrochloride
CID 171201666
3-(1-amino-2-fluoroethyl)phenol
CID 83815443
6-[(1S,2R)-1-amino-2-hydroxy-3-methylbutyl]naphthalen-2-ol;hydrochloride
CID 171267170
ethyl (3R)-3-amino-2-fluoro-3-(6-hydroxynaphthalen-2-yl)propanoate;hydrochloride
CID 171240201
6-[(1R,2S)-1-amino-2-hydroxypentyl]naphthalen-2-ol;hydrochloride
CID 171261493
6-[(1R)-2-fluoro-1-piperazin-1-ylethyl]naphthalen-2-ol;dihydrochloride
CID 171275145
6-(1-iodoethyl)naphthalen-2-ol
CID 147688563
4-(1-amino-2-fluoroethyl)benzene-1,3-diol
CID 130061010
(3R)-3-amino-3-naphthalen-2-ylpropanoic acid;hydrochloride
CID 127263273

Frequently Asked Questions

What is the IUPAC name of 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride?
The IUPAC name of 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride (CID 171221161) is 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride.
What is the SMILES notation for 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride?
The canonical SMILES for 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride is Cl.N[C@@H](CF)c1ccc2cc(O)ccc2c1.
What is the InChIKey of 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride?
The InChIKey is ZPXGDPMRCSJKKD-YDALLXLXSA-N. The full InChI is InChI=1S/C12H12FNO.ClH/c13-7-12(14)10-2-1-9-6-11(15)4-3-8(9)5-10;/h1-6,12,15H,7,14H2;1H/t12-;/m0./s1.
What are the key properties of 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride?
6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride has a molecular weight of 241.69 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1R)-1-amino-2-fluoroethyl]naphthalen-2-ol;hydrochloride is sourced from PubChem (CID 171221161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).