8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one

C19H20N2O2 — CID 70411248

IUPAC8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one
SMILESO=c1ccc2c(CCNCCc3ccccc3)ccc(O)c2[nH]1
InChIInChI=1S/C19H20N2O2/c22-17-8-6-15(16-7-9-18(23)21-19(16)17)11-13-20-12-10-14-4-2-1-3-5-14/h1-9,20,22H,10-13H2,(H,21,23)
InChIKeyUPNPCIGYTHMNRO-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.61
Rot. Bonds6

About 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one

8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one (PubChem CID 70411248) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one
PubChem CID70411248
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one
SMILESO=c1ccc2c(CCNCCc3ccccc3)ccc(O)c2[nH]1
InChIInChI=1S/C19H20N2O2/c22-17-8-6-15(16-7-9-18(23)21-19(16)17)11-13-20-12-10-14-4-2-1-3-5-14/h1-9,20,22H,10-13H2,(H,21,23)
InChIKeyUPNPCIGYTHMNRO-UHFFFAOYSA-N
XLogP2.61
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

8-hydroxy-5-[(1R)-1-hydroxy-2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one
CID 140957131
N-[(2R)-butan-2-yl]-N-[2-[2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethylamino]ethyl]-3-(2-phenylethoxy)propanamide;hydrochloride
CID 68708562
5-[2-(2,3-dihydro-1H-inden-2-ylamino)ethyl]-8-hydroxy-1H-quinolin-2-one
CID 11695444
5-[2-(benzylamino)ethyl]-8-methoxy-1H-quinolin-2-one
CID 70410415
3-[2-(4-chlorophenyl)ethylamino]-N-cyclohexyl-N-[2-[2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethylamino]ethyl]propanamide
CID 24959989
4-[2-[[(2S)-2-hydroxy-2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethyl]amino]ethyl]benzoic acid
CID 118364118
5-[2-[2-[4-[2-(1-azoniabicyclo[2.2.2]octan-1-yl)ethoxy]phenoxy]ethylamino]ethyl]-8-hydroxy-1H-quinolin-2-one
CID 135139061
N-cycloheptyl-3-[2-(3-fluorophenyl)ethylamino]-N-[2-[2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethylamino]ethyl]propanamide;1,1,1,4,4,4-hexafluorobutane-2,3-dione
CID 157388112
N-cycloheptyl-3-[2-(3-ethoxyphenyl)ethylamino]-N-[2-[2-(8-hydroxy-2-oxo-1H-quinolin-5-yl)ethylamino]ethyl]propanamide;bis(2,2,2-trifluoroacetic acid)
CID 87544299
5-[2-[2-[2-amino-4-(3-phenylphenyl)phenyl]ethylamino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one
CID 90901841
5-[2-[(5,6-diethyl-2,3-dihydro-1H-inden-2-yl)amino]ethyl]-8-hydroxy-1H-quinolin-2-one;2-hydroxyacetic acid
CID 68877343
8-hydroxy-5-[1-hydroxy-2-[2-[4-(4-methyl-3-phenylanilino)phenyl]ethylamino]ethyl]-1H-quinolin-2-one
CID 20605106

Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one?
The IUPAC name of 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one (CID 70411248) is 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one.
What is the SMILES notation for 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one?
The canonical SMILES for 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one is O=c1ccc2c(CCNCCc3ccccc3)ccc(O)c2[nH]1.
What is the InChIKey of 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one?
The InChIKey is UPNPCIGYTHMNRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-17-8-6-15(16-7-9-18(23)21-19(16)17)11-13-20-12-10-14-4-2-1-3-5-14/h1-9,20,22H,10-13H2,(H,21,23).
What are the key properties of 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one?
8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one has a molecular weight of 308.38 g/mol, XLogP of 2.61, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-5-[2-(2-phenylethylamino)ethyl]-1H-quinolin-2-one is sourced from PubChem (CID 70411248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).