2,3-Dihydroquinolin-4(1H)-one

C₉H₉NOCAS 4295-36-7147.18 g/mol

Open in Covalent MOL file

Ketone Secondary amine

Properties

Molecular formula: C₉H₉NO
Molar mass: 147.18 g/mol
Exact mass: 147.0684 Da
logP: 1.68Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

4295-36-7

SMILES

C1CNC2=CC=CC=C2C1=O

InChIKey

BUWPZNOVIHAWHW-UHFFFAOYSA-N

InChI

InChI=1S/C9H9NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-4,10H,5-6H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2,3-Dihydro-1H-quinolin-4-one

Work with 2,3-Dihydroquinolin-4(1H)-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,2,3,4-Tetrahydro-benzo(b)azepin-5-one1127-74-879 % similar 2,3,4,5-Tetrahydro-1H-1-benzazepine-2,5-dione16511-38-958 % similar DE(5-carboxamide)oxcarbazepine21737-58-649 % similar 1-Tetralone529-34-048 % similar Benzosuberone826-73-347 % similar 1-Indanone83-33-047 % similar 7-Chloro-2,3,4,5-tetrahydro-1H-1-benzazepin-5-one160129-45-346 % similar 1,3-Indandione606-23-545 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Methoxyindole1006-94-6 (4-Methoxyphenyl)acetonitrile104-47-2 Indole-4-methanol1074-85-7 1H-Indole-7-methanol1074-87-9 Indole-5-methanol1075-25-8 6-Hydroxymethylindole1075-26-9 3,4-Dihydroisoquinolin-1(2H)-one1196-38-9 2-Methyl-1H-indol-5-ol13314-85-7

Elsewhere

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