5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid

C9H10N2O2 — CID 51358533

IUPAC5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2c(n1)NCCC2
InChIInChI=1S/C9H10N2O2/c12-9(13)7-4-3-6-2-1-5-10-8(6)11-7/h3-4H,1-2,5H2,(H,10,11)(H,12,13)
InChIKeyQNZSCAGHBLVEKF-UHFFFAOYSA-N
MW178.19 g/mol
LogP1.14
Rot. Bonds1

About 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid

5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid (PubChem CID 51358533) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid.

Molecular Properties

Compound Name5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid
PubChem CID51358533
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2c(n1)NCCC2
InChIInChI=1S/C9H10N2O2/c12-9(13)7-4-3-6-2-1-5-10-8(6)11-7/h3-4H,1-2,5H2,(H,10,11)(H,12,13)
InChIKeyQNZSCAGHBLVEKF-UHFFFAOYSA-N
XLogP1.14
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid?
The IUPAC name of 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid (CID 51358533) is 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid.
What is the SMILES notation for 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid?
The canonical SMILES for 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid is O=C(O)c1ccc2c(n1)NCCC2.
What is the InChIKey of 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid?
The InChIKey is QNZSCAGHBLVEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c12-9(13)7-4-3-6-2-1-5-10-8(6)11-7/h3-4H,1-2,5H2,(H,10,11)(H,12,13).
What are the key properties of 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid?
5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid has a molecular weight of 178.19 g/mol, XLogP of 1.14, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydro-1,8-naphthyridine-2-carboxylic acid is sourced from PubChem (CID 51358533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).