7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride

C9H11ClFNO — CID 105455876

IUPAC7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride
SMILESCl.OC1CNc2cc(F)ccc2C1
InChIInChI=1S/C9H10FNO.ClH/c10-7-2-1-6-3-8(12)5-11-9(6)4-7;/h1-2,4,8,11-12H,3,5H2;1H
InChIKeyNNBMHJZJIKKWIS-UHFFFAOYSA-N
MW203.64 g/mol
LogP1.58
Rot. Bonds

About 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride

7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride (PubChem CID 105455876) has the molecular formula C9H11ClFNO and a molecular weight of 203.64 g/mol. Its IUPAC name is 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride.

Molecular Properties

Compound Name7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride
PubChem CID105455876
Molecular FormulaC9H11ClFNO
Molecular Weight203.64 g/mol
Exact Mass203.05
IUPAC Name7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride
SMILESCl.OC1CNc2cc(F)ccc2C1
InChIInChI=1S/C9H10FNO.ClH/c10-7-2-1-6-3-8(12)5-11-9(6)4-7;/h1-2,4,8,11-12H,3,5H2;1H
InChIKeyNNBMHJZJIKKWIS-UHFFFAOYSA-N
XLogP1.58
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.64
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 7-fluoro-1,2,3,4-tetrahydroquinolin-3-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

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride?
The IUPAC name of 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride (CID 105455876) is 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride.
What is the SMILES notation for 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride?
The canonical SMILES for 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride is Cl.OC1CNc2cc(F)ccc2C1.
What is the InChIKey of 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride?
The InChIKey is NNBMHJZJIKKWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO.ClH/c10-7-2-1-6-3-8(12)5-11-9(6)4-7;/h1-2,4,8,11-12H,3,5H2;1H.
What are the key properties of 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride?
7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride has a molecular weight of 203.64 g/mol, XLogP of 1.58, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1,2,3,4-tetrahydroquinolin-3-ol;hydrochloride is sourced from PubChem (CID 105455876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).