9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid

C11H10N2O6 — CID 91227495

IUPAC9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid
SMILESO=C(O)c1cn2ccn(CCO)c(=O)c2c(O)c1=O
InChIInChI=1S/C11H10N2O6/c14-4-3-12-1-2-13-5-6(11(18)19)8(15)9(16)7(13)10(12)17/h1-2,5,14,16H,3-4H2,(H,18,19)
InChIKeyUDQNGTZCKGQEDD-UHFFFAOYSA-N
MW266.21 g/mol
LogP-1.14
Rot. Bonds3

About 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid

9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid (PubChem CID 91227495) has the molecular formula C11H10N2O6 and a molecular weight of 266.21 g/mol. Its IUPAC name is 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid.

Molecular Properties

Compound Name9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid
PubChem CID91227495
Molecular FormulaC11H10N2O6
Molecular Weight266.21 g/mol
Exact Mass266.05
IUPAC Name9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid
SMILESO=C(O)c1cn2ccn(CCO)c(=O)c2c(O)c1=O
InChIInChI=1S/C11H10N2O6/c14-4-3-12-1-2-13-5-6(11(18)19)8(15)9(16)7(13)10(12)17/h1-2,5,14,16H,3-4H2,(H,18,19)
InChIKeyUDQNGTZCKGQEDD-UHFFFAOYSA-N
XLogP-1.14
TPSA121.24 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.21
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

2-[[4-(dimethylamino)phenyl]methyl]-9-hydroxy-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid
CID 91039232
N-[(2,4-difluorophenyl)methyl]-9-hydroxy-2-(4-hydroxybutyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxamide
CID 170855321
sodium;7-(2,2-dimethylpropanoyl)-2-[(4-fluorophenyl)methyl]-9-hydroxypyrido[1,2-a]pyrazine-1,8-dione;hydride
CID 173127970
2-[(4-fluorophenyl)methyl]-9-hydroxy-7-(3-methylbutanoyl)pyrido[1,2-a]pyrazine-1,8-dione
CID 54683549
2-[3-(2-chloro-6-fluorophenyl)propyl]-7-(2,2-dimethylpropanoyl)-9-hydroxypyrido[1,2-a]pyrazine-1,8-dione;hydrochloride
CID 54683328
9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxo-3,4-dihydropyrido[1,2-a]pyrazine-7-carboxylic acid
CID 91540634
2-[(4-fluorophenyl)methyl]-1,8-dioxo-9-phenylmethoxypyrido[1,2-a]pyrazine-7-carboxylic acid
CID 90991081
1-(2-hydroxyethyl)-8-methyl-4-oxoquinoline-3-carboxylic acid
CID 82244448
1-(3-hydroxypropyl)-2-oxopyridine-3-carboxylic acid
CID 22498647
2-[(4-fluorophenyl)methyl]-9-hydroxy-7-pyridin-4-ylpyrido[1,2-a]pyrazine-1,8-dione
CID 54683507
1-(2-hydroxyethyl)-5,6-dimethylindole-3-carboxylic acid
CID 83947394
7-amino-2-[(3-chlorophenyl)methyl]-9-hydroxypyrido[1,2-a]pyrazine-1,8-dione
CID 54683295

Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid?
The IUPAC name of 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid (CID 91227495) is 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid.
What is the SMILES notation for 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid?
The canonical SMILES for 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid is O=C(O)c1cn2ccn(CCO)c(=O)c2c(O)c1=O.
What is the InChIKey of 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid?
The InChIKey is UDQNGTZCKGQEDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O6/c14-4-3-12-1-2-13-5-6(11(18)19)8(15)9(16)7(13)10(12)17/h1-2,5,14,16H,3-4H2,(H,18,19).
What are the key properties of 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid?
9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid has a molecular weight of 266.21 g/mol, XLogP of -1.14, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-2-(2-hydroxyethyl)-1,8-dioxopyrido[1,2-a]pyrazine-7-carboxylic acid is sourced from PubChem (CID 91227495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).