1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one

C15H16N2O2 — CID 16789221

IUPAC1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one
SMILESNC(CN1C(=O)CCc2ccccc21)c1ccco1
InChIInChI=1S/C15H16N2O2/c16-12(14-6-3-9-19-14)10-17-13-5-2-1-4-11(13)7-8-15(17)18/h1-6,9,12H,7-8,10,16H2
InChIKeyKTSSIOQSZUCBRP-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.26
Rot. Bonds3

About 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one

1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one (PubChem CID 16789221) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one
PubChem CID16789221
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one
SMILESNC(CN1C(=O)CCc2ccccc21)c1ccco1
InChIInChI=1S/C15H16N2O2/c16-12(14-6-3-9-19-14)10-17-13-5-2-1-4-11(13)7-8-15(17)18/h1-6,9,12H,7-8,10,16H2
InChIKeyKTSSIOQSZUCBRP-UHFFFAOYSA-N
XLogP2.26
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-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

1-(2-amino-3,3-dimethylbutyl)-3,4-dihydroquinolin-2-one
CID 16792075
1-[(2S)-2-aminopropyl]-4,5-dihydro-3H-1-benzazepin-2-one
CID 103934798
1-[(2S)-2-hydroxypropyl]-3,4-dihydroquinolin-2-one
CID 103935304
1-ethyl-3,4-dihydroquinolin-2-one
CID 14580225
1-(2-amino-3,3-dimethylbutyl)-4,5-dihydro-3H-1-benzazepin-2-one
CID 43165250
1-(2-chloroethyl)-3,4-dihydroquinolin-2-one
CID 12992360
ethyl 3-hydroxy-4-(2-oxo-3,4-dihydroquinolin-1-yl)butanoate
CID 82778791
1-(5-aminopentyl)-3,4-dihydroquinolin-2-one
CID 54965763
2-acetamido-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanoic acid
CID 64583291
1-[2-amino-2-(2,6-difluorophenyl)ethyl]-3H-indol-2-one
CID 18071013
1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 63915018
1-[2-cyclohexyl-2-(methylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 104747147

Frequently Asked Questions

What is the IUPAC name of 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one (CID 16789221) is 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one is NC(CN1C(=O)CCc2ccccc21)c1ccco1.
What is the InChIKey of 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one?
The InChIKey is KTSSIOQSZUCBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c16-12(14-6-3-9-19-14)10-17-13-5-2-1-4-11(13)7-8-15(17)18/h1-6,9,12H,7-8,10,16H2.
What are the key properties of 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one?
1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one has a molecular weight of 256.31 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-amino-2-(furan-2-yl)ethyl]-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 16789221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).