3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one

C9H9FN2O — CID 84618485

IUPAC3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one
SMILESNC1Cc2cccc(F)c2NC1=O
InChIInChI=1S/C9H9FN2O/c10-6-3-1-2-5-4-7(11)9(13)12-8(5)6/h1-3,7H,4,11H2,(H,12,13)
InChIKeyQREIHYDZWAJVAZ-UHFFFAOYSA-N
MW180.18 g/mol
LogP0.65
Rot. Bonds

About 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one

3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one (PubChem CID 84618485) has the molecular formula C9H9FN2O and a molecular weight of 180.18 g/mol. Its IUPAC name is 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one
PubChem CID84618485
Molecular FormulaC9H9FN2O
Molecular Weight180.18 g/mol
Exact Mass180.07
IUPAC Name3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one
SMILESNC1Cc2cccc(F)c2NC1=O
InChIInChI=1S/C9H9FN2O/c10-6-3-1-2-5-4-7(11)9(13)12-8(5)6/h1-3,7H,4,11H2,(H,12,13)
InChIKeyQREIHYDZWAJVAZ-UHFFFAOYSA-N
XLogP0.65
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.18
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one 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

(3R)-3-amino-9-fluoro-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 51777322
3-amino-3,4-dihydro-1H-quinolin-2-one;hydroiodide
CID 17234022
5-amino-9-fluoro-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 82401385
4-(2-aminoethyl)-8-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 84621055
2-(aminomethyl)-5-fluoro-4H-1,4-benzothiazin-3-one
CID 84621659
(3S)-3-amino-6-fluoro-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 129390859
8-fluoro-3,3-dimethyl-1,4-dihydroquinolin-2-one
CID 102357907
(3S)-3-amino-6-fluoro-1-[3-(trifluoromethyl)phenyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one
CID 90087754
2-(difluoromethyl)-7-fluoro-2,3-dihydro-1H-indole
CID 84660863
(3R)-8-fluoro-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 96622835
8-fluoro-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 105447942
8-fluoro-3-piperidin-4-yl-1,4-dihydroquinazolin-2-one;hydrochloride
CID 68825666

Frequently Asked Questions

What is the IUPAC name of 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one (CID 84618485) is 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one is NC1Cc2cccc(F)c2NC1=O.
What is the InChIKey of 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is QREIHYDZWAJVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2O/c10-6-3-1-2-5-4-7(11)9(13)12-8(5)6/h1-3,7H,4,11H2,(H,12,13).
What are the key properties of 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one?
3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 180.18 g/mol, XLogP of 0.65, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-8-fluoro-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 84618485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).