3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one

C12H13FN2O — CID 84623506

IUPAC3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one
SMILESCC(N)Cc1cc2cccc(F)c2[nH]c1=O
InChIInChI=1S/C12H13FN2O/c1-7(14)5-9-6-8-3-2-4-10(13)11(8)15-12(9)16/h2-4,6-7H,5,14H2,1H3,(H,15,16)
InChIKeyADKKBJORRKALOL-UHFFFAOYSA-N
MW220.25 g/mol
LogP1.56
Rot. Bonds2

About 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one

3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one (PubChem CID 84623506) has the molecular formula C12H13FN2O and a molecular weight of 220.25 g/mol. Its IUPAC name is 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one.

Molecular Properties

Compound Name3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one
PubChem CID84623506
Molecular FormulaC12H13FN2O
Molecular Weight220.25 g/mol
Exact Mass220.10
IUPAC Name3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one
SMILESCC(N)Cc1cc2cccc(F)c2[nH]c1=O
InChIInChI=1S/C12H13FN2O/c1-7(14)5-9-6-8-3-2-4-10(13)11(8)15-12(9)16/h2-4,6-7H,5,14H2,1H3,(H,15,16)
InChIKeyADKKBJORRKALOL-UHFFFAOYSA-N
XLogP1.56
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(2-aminopropyl)-8-fluoro-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

(1R)-1-(7-fluoro-1H-indol-2-yl)ethanamine
CID 96742272
(2S)-2-amino-2-(7-fluoro-1H-indol-2-yl)ethanol
CID 96754178
2-amino-3-(8-chloro-2-oxo-1H-quinolin-3-yl)propanoic acid
CID 84640250
(8-methyl-2-oxo-1H-quinolin-3-yl)methyl-propan-2-ylazanium
CID 2066167
3-[[(2-fluorophenyl)methylamino]methyl]-8-methyl-1H-quinolin-2-one
CID 18525037
(2R)-1-(3-fluoro-2-methylphenyl)propan-2-amine
CID 130795022
2-[2-(2-aminopropyl)-6-fluorophenyl]sulfanyl-4-methyl-1H-pyrimidin-6-one
CID 136730622
3-ethyl-8-methyl-1H-quinolin-2-one
CID 143939354
1-(5,7-difluoro-1H-indol-6-yl)propan-2-amine
CID 117300028
3-[2-[amino(hydroxy)methyl]-3-methylbutyl]-6-(8-fluoronaphthalen-2-yl)-1H-pyridin-2-one
CID 137490792
bis(7-fluoro-1H-indol-2-yl)methanone
CID 152595291
1-[2-(2-fluorophenyl)phenyl]propan-2-amine
CID 170864653

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one?
The IUPAC name of 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one (CID 84623506) is 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one.
What is the SMILES notation for 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one?
The canonical SMILES for 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one is CC(N)Cc1cc2cccc(F)c2[nH]c1=O.
What is the InChIKey of 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one?
The InChIKey is ADKKBJORRKALOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O/c1-7(14)5-9-6-8-3-2-4-10(13)11(8)15-12(9)16/h2-4,6-7H,5,14H2,1H3,(H,15,16).
What are the key properties of 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one?
3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one has a molecular weight of 220.25 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopropyl)-8-fluoro-1H-quinolin-2-one is sourced from PubChem (CID 84623506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).