1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one

C17H18N2O3 — CID 54677707

IUPAC1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one
SMILESCCn1c(=O)c(C(C)Nc2ccco2)c(O)c2ccccc21
InChIInChI=1S/C17H18N2O3/c1-3-19-13-8-5-4-7-12(13)16(20)15(17(19)21)11(2)18-14-9-6-10-22-14/h4-11,18,20H,3H2,1-2H3
InChIKeyQVXYERVLXHQBJN-UHFFFAOYSA-N
MW298.34 g/mol
LogP3.49
Rot. Bonds4

About 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one

1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one (PubChem CID 54677707) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one.

Molecular Properties

Compound Name1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one
PubChem CID54677707
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one
SMILESCCn1c(=O)c(C(C)Nc2ccco2)c(O)c2ccccc21
InChIInChI=1S/C17H18N2O3/c1-3-19-13-8-5-4-7-12(13)16(20)15(17(19)21)11(2)18-14-9-6-10-22-14/h4-11,18,20H,3H2,1-2H3
InChIKeyQVXYERVLXHQBJN-UHFFFAOYSA-N
XLogP3.49
TPSA67.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[Ethyl(furan-3-ylmethyl)amino]-4-(trifluoromethyl)-1,2-dihydroquinolin-2-one
CID 23648058
3-acetamido-N-[2-(furan-2-yl)ethyl]benzamide
CID 9506757
N-(furan-2-ylmethyl)-4-hydroxy-1-(3-methylbutyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 54679555
N-(2-furylmethyl)-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide
CID 3237343
N-[3-(2-furyl)-1-methylpropyl]-2-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)thio]acetamide
CID 3242445
2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]-N-(2-furylmethyl)acetamide
CID 3243114
N-[(5-methyl-2-furyl)methyl]-4-[(1-methyl-2-oxo-1,2-dihydroquinolin-4-yl)oxy]butanamide
CID 3244647
N-(furan-2-ylmethyl)-4-hydroxy-2-oxo-1-pentyl-1,2-dihydroquinoline-3-carboxamide
CID 54693587
[2-(furan-3-yl)-1,3-dimethyl-2,4-dihydroquinazolin-6-yl] N-heptylcarbamate
CID 127032709
1-butyl-N-(furan-2-ylmethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 54680132
Furan-2-yl-(1-phenyl-but-3-enyl)-amine
CID 6603343
1-(2-{[Cyclohexyl(methyl)amino]methyl}phenyl)-3-[(furan-3-yl)methyl]urea
CID 47038967

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one?
The IUPAC name of 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one (CID 54677707) is 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one.
What is the SMILES notation for 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one?
The canonical SMILES for 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one is CCn1c(=O)c(C(C)Nc2ccco2)c(O)c2ccccc21.
What is the InChIKey of 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one?
The InChIKey is QVXYERVLXHQBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-3-19-13-8-5-4-7-12(13)16(20)15(17(19)21)11(2)18-14-9-6-10-22-14/h4-11,18,20H,3H2,1-2H3.
What are the key properties of 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one?
1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one has a molecular weight of 298.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[1-(furan-2-ylamino)ethyl]-4-hydroxyquinolin-2-one is sourced from PubChem (CID 54677707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).