N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide

C15H18N2O4 — CID 134233784

IUPACN-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide
SMILESCCCOn1c(=O)c(C(=O)NCC)c(O)c2ccccc21
InChIInChI=1S/C15H18N2O4/c1-3-9-21-17-11-8-6-5-7-10(11)13(18)12(15(17)20)14(19)16-4-2/h5-8,18H,3-4,9H2,1-2H3,(H,16,19)
InChIKeyTVVAOKGNYJLDRD-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.30
Rot. Bonds5

About N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide

N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide (PubChem CID 134233784) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide
PubChem CID134233784
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC NameN-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide
SMILESCCCOn1c(=O)c(C(=O)NCC)c(O)c2ccccc21
InChIInChI=1S/C15H18N2O4/c1-3-9-21-17-11-8-6-5-7-10(11)13(18)12(15(17)20)14(19)16-4-2/h5-8,18H,3-4,9H2,1-2H3,(H,16,19)
InChIKeyTVVAOKGNYJLDRD-UHFFFAOYSA-N
XLogP1.30
TPSA80.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-4,6-dihydroxy-2-oxo-1-propoxyquinoline-3-carboxamide
CID 134233787
1-[(4-cyanophenyl)methoxy]-N-ethyl-4-hydroxy-2-oxoquinoline-3-carboxamide;formic acid
CID 144658108
2-[[4-hydroxy-2-oxo-1-(2,2,2-trifluoroethoxy)quinoline-3-carbonyl]amino]acetic acid
CID 118451781
methyl 2-[(1-but-2-ynoxy-4-hydroxy-2-oxoquinoline-3-carbonyl)amino]acetate
CID 90269438
ethyl 3-aminoiodanuidylpropanoate;ethyl 2-[(1-butoxy-4-hydroxy-2-oxoquinoline-3-carbonyl)amino]acetate;ethyl 1-butoxy-4-hydroxy-2-oxoquinoline-3-carboxylate;iodoethane
CID 159040048
N-[2-(ethylamino)ethyl]-4-hydroxy-1-methyl-2-oxoquinoline-3-carboxamide;hydrochloride
CID 56684063
4,6-dihydroxy-2-oxo-1-propoxyquinoline-3-carboxamide
CID 151201427
4-hydroxy-1-methyl-2-oxo-N-(4-propoxyphenyl)quinoline-3-carboxamide
CID 54677084
4-hydroxy-N-(2-hydroxyethyl)-2-oxo-1-propylquinoline-3-carboxamide
CID 54706310
2-hydroxyethyl-[2-[(4-hydroxy-2-oxo-1-propylquinoline-3-carbonyl)amino]ethyl]azanium
CID 54697176
1-ethyl-N-[2-(ethylamino)ethyl]-4-hydroxy-2-oxoquinoline-3-carboxamide;hydrochloride
CID 54686774
N-[2-(dimethylamino)ethyl]-4-hydroxy-2-oxo-1-propylquinoline-3-carboxamide
CID 54688406

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide?
The IUPAC name of N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide (CID 134233784) is N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide.
What is the SMILES notation for N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide?
The canonical SMILES for N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide is CCCOn1c(=O)c(C(=O)NCC)c(O)c2ccccc21.
What is the InChIKey of N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide?
The InChIKey is TVVAOKGNYJLDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-3-9-21-17-11-8-6-5-7-10(11)13(18)12(15(17)20)14(19)16-4-2/h5-8,18H,3-4,9H2,1-2H3,(H,16,19).
What are the key properties of N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide?
N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-hydroxy-2-oxo-1-propoxyquinoline-3-carboxamide is sourced from PubChem (CID 134233784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).