4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide

C13H14N2O4 — CID 54687811

IUPAC4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide
SMILESCn1c(=O)c(C(=O)NCCO)c(O)c2ccccc21
InChIInChI=1S/C13H14N2O4/c1-15-9-5-3-2-4-8(9)11(17)10(13(15)19)12(18)14-6-7-16/h2-5,16-17H,6-7H2,1H3,(H,14,18)
InChIKeyFLWYDXJZWBNEAW-UHFFFAOYSA-N
MW262.27 g/mol
LogP-0.03
Rot. Bonds3

About 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide

4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide (PubChem CID 54687811) has the molecular formula C13H14N2O4 and a molecular weight of 262.27 g/mol. Its IUPAC name is 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide
PubChem CID54687811
Molecular FormulaC13H14N2O4
Molecular Weight262.27 g/mol
Exact Mass262.10
IUPAC Name4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide
SMILESCn1c(=O)c(C(=O)NCCO)c(O)c2ccccc21
InChIInChI=1S/C13H14N2O4/c1-15-9-5-3-2-4-8(9)11(17)10(13(15)19)12(18)14-6-7-16/h2-5,16-17H,6-7H2,1H3,(H,14,18)
InChIKeyFLWYDXJZWBNEAW-UHFFFAOYSA-N
XLogP-0.03
TPSA91.56 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-Dihydroxyquinoline
CID 54680871
Roquinimex
CID 54676478
3-Quinolinecarboxylic acid, 1,2-dihydro-4-hydroxy-1-methyl-2-oxo-, ethyl ester
CID 54682929
4-Hydroxy-N-methylcarbostyril
CID 54686436
3-Quinolinecarboxamide, 1,2-dihydro-N-hexyl-4-hydroxy-2-oxo-
CID 54677800
N-(1-Benzyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbonyl)glycine
CID 54685215
Desidustat
CID 75593290
Ethyl 4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylate
CID 54684458
3-Quinolinecarboxamide, 1,2-dihydro-N-ethyl-4-hydroxy-2-oxo-
CID 54680440
3-Quinolinecarboxamide, 1,2-dihydro-4-hydroxy-N-(1-methylethyl)-2-oxo-
CID 54679386
Ethyl 1-ethyl-1,2-dihydro-4-hydroxy-2-oxo-3-quinolinecarboxylate
CID 54680568
1-Hydroxy-3-oxo-6,7-dihydro-3H,5H-pyrido[3,2,1-ij]quinoline-2-carboxylic acid methylamide
CID 54676926

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide (CID 54687811) is 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide is Cn1c(=O)c(C(=O)NCCO)c(O)c2ccccc21.
What is the InChIKey of 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide?
The InChIKey is FLWYDXJZWBNEAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4/c1-15-9-5-3-2-4-8(9)11(17)10(13(15)19)12(18)14-6-7-16/h2-5,16-17H,6-7H2,1H3,(H,14,18).
What are the key properties of 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide?
4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide has a molecular weight of 262.27 g/mol, XLogP of -0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-hydroxyethyl)-1-methyl-2-oxoquinoline-3-carboxamide is sourced from PubChem (CID 54687811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).