(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid

C10H10FNO2 — CID 96622835

IUPAC(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
SMILESO=C(O)[C@H]1CNc2c(F)cccc2C1
InChIInChI=1S/C10H10FNO2/c11-8-3-1-2-6-4-7(10(13)14)5-12-9(6)8/h1-3,7,12H,4-5H2,(H,13,14)/t7-/m1/s1
InChIKeyRIQPCUUBVRRTFV-SSDOTTSWSA-N
MW195.19 g/mol
LogP1.49
Rot. Bonds1

About (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid

(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid (PubChem CID 96622835) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
PubChem CID96622835
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
SMILESO=C(O)[C@H]1CNc2c(F)cccc2C1
InChIInChI=1S/C10H10FNO2/c11-8-3-1-2-6-4-7(10(13)14)5-12-9(6)8/h1-3,7,12H,4-5H2,(H,13,14)/t7-/m1/s1
InChIKeyRIQPCUUBVRRTFV-SSDOTTSWSA-N
XLogP1.49
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid 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

9-fluoro-2,3,4,5-tetrahydro-1H-1-benzazepine-4-carboxylic acid
CID 82395177
(3R)-8-methoxy-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 96616866
[(3S)-8-fluoro-1,2,3,4-tetrahydroquinolin-3-yl]methanol
CID 42333638
(3S)-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 34181194
8-fluoro-3,4-dihydro-2H-thiochromene-3-carboxylic acid
CID 19982162
7-[2-(2-chloro-6-fluorophenyl)ethyl]-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 174826354
9-(trifluoromethyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-4-carboxylic acid
CID 83672503
2,3,4,5-tetrahydro-1H-2-benzazepine-4-carboxylic acid;hydrobromide
CID 156758919
disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride
CID 173251406
5-(2,6-difluorophenyl)pyrrolidine-3-carboxylic acid
CID 117326291
6-hydroxy-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 54367728
7-methyl-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 83753051

Frequently Asked Questions

What is the IUPAC name of (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
The IUPAC name of (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid (CID 96622835) is (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid.
What is the SMILES notation for (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
The canonical SMILES for (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid is O=C(O)[C@H]1CNc2c(F)cccc2C1.
What is the InChIKey of (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
The InChIKey is RIQPCUUBVRRTFV-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H10FNO2/c11-8-3-1-2-6-4-7(10(13)14)5-12-9(6)8/h1-3,7,12H,4-5H2,(H,13,14)/t7-/m1/s1.
What are the key properties of (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid?
(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid has a molecular weight of 195.19 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid is sourced from PubChem (CID 96622835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).