6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid

C9H10N2O3 — CID 69401533

IUPAC6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid
SMILESO=C(O)N1CCc2cc(=O)[nH]cc2C1
InChIInChI=1S/C9H10N2O3/c12-8-3-6-1-2-11(9(13)14)5-7(6)4-10-8/h3-4H,1-2,5H2,(H,10,12)(H,13,14)
InChIKeyNRRPBZSTRBUZLQ-UHFFFAOYSA-N
MW194.19 g/mol
LogP0.41
Rot. Bonds

About 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid

6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid (PubChem CID 69401533) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid
PubChem CID69401533
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid
SMILESO=C(O)N1CCc2cc(=O)[nH]cc2C1
InChIInChI=1S/C9H10N2O3/c12-8-3-6-1-2-11(9(13)14)5-7(6)4-10-8/h3-4H,1-2,5H2,(H,10,12)(H,13,14)
InChIKeyNRRPBZSTRBUZLQ-UHFFFAOYSA-N
XLogP0.41
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,6,7-tetrahydropyrrolo[3,4-c]pyridine-5-carboxylic acid
CID 68725346
7-(1,1-dihydroxythiane-4-carbonyl)-2,5,6,8-tetrahydro-2,7-naphthyridin-3-one
CID 174213118
7-(3-methyl-1,2-oxazole-5-carbonyl)-2,5,6,8-tetrahydro-2,7-naphthyridin-3-one
CID 156864966
N-(4,5-dichloro-2-pyridinyl)-6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxamide
CID 169209029
7-[2-hydroxy-3,5-di(propan-2-yl)benzoyl]-2,5,6,8-tetrahydro-2,7-naphthyridin-3-one
CID 176500063
7-[3-(1H-indol-3-yl)propanoyl]-2,5,6,8-tetrahydro-2,7-naphthyridin-3-one
CID 176506843
3,4-dihydro-1H-2,6-naphthyridine-2,7-dicarboxylic acid
CID 155143574
6-(hydroxymethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid
CID 118007702
6-amino-3,4-dihydro-1H-2,7-naphthyridine-2-carboxylic acid
CID 70299304
5,6,7,8-tetrahydro-2H-isoquinolin-3-one
CID 14494728
N-(3-chloro-4-methylphenyl)-7-oxo-1,3,4,6-tetrahydro-2,6-naphthyridine-2-carboxamide
CID 162376955
6-(dimethylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid
CID 175419629

Frequently Asked Questions

What is the IUPAC name of 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid?
The IUPAC name of 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid (CID 69401533) is 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid.
What is the SMILES notation for 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid?
The canonical SMILES for 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid is O=C(O)N1CCc2cc(=O)[nH]cc2C1.
What is the InChIKey of 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid?
The InChIKey is NRRPBZSTRBUZLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c12-8-3-6-1-2-11(9(13)14)5-7(6)4-10-8/h3-4H,1-2,5H2,(H,10,12)(H,13,14).
What are the key properties of 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid?
6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid has a molecular weight of 194.19 g/mol, XLogP of 0.41, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-1,3,4,7-tetrahydro-2,7-naphthyridine-2-carboxylic acid is sourced from PubChem (CID 69401533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).