4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid

C9H10N2O4 — CID 68866198

IUPAC4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid
SMILESO=C(O)c1c(O)c2c([nH]c1=O)CNCC2
InChIInChI=1S/C9H10N2O4/c12-7-4-1-2-10-3-5(4)11-8(13)6(7)9(14)15/h10H,1-3H2,(H,14,15)(H2,11,12,13)
InChIKeyNGHNEZAYONNQRJ-UHFFFAOYSA-N
MW210.19 g/mol
LogP-0.58
Rot. Bonds1

About 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid

4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid (PubChem CID 68866198) has the molecular formula C9H10N2O4 and a molecular weight of 210.19 g/mol. Its IUPAC name is 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid
PubChem CID68866198
Molecular FormulaC9H10N2O4
Molecular Weight210.19 g/mol
Exact Mass210.06
IUPAC Name4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid
SMILESO=C(O)c1c(O)c2c([nH]c1=O)CNCC2
InChIInChI=1S/C9H10N2O4/c12-7-4-1-2-10-3-5(4)11-8(13)6(7)9(14)15/h10H,1-3H2,(H,14,15)(H2,11,12,13)
InChIKeyNGHNEZAYONNQRJ-UHFFFAOYSA-N
XLogP-0.58
TPSA102.42 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 5-0.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid?
The IUPAC name of 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid (CID 68866198) is 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid.
What is the SMILES notation for 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid?
The canonical SMILES for 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid is O=C(O)c1c(O)c2c([nH]c1=O)CNCC2.
What is the InChIKey of 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid?
The InChIKey is NGHNEZAYONNQRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O4/c12-7-4-1-2-10-3-5(4)11-8(13)6(7)9(14)15/h10H,1-3H2,(H,14,15)(H2,11,12,13).
What are the key properties of 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid?
4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid has a molecular weight of 210.19 g/mol, XLogP of -0.58, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-1,7-naphthyridine-3-carboxylic acid is sourced from PubChem (CID 68866198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).