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

C9H11ClN2O2 — CID 122156783

IUPAC5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1ccc2c(n1)CCCN2
InChIInChI=1S/C9H10N2O2.ClH/c12-9(13)8-4-3-6-7(11-8)2-1-5-10-6;/h3-4,10H,1-2,5H2,(H,12,13);1H
InChIKeyHMSGDHBBKNUZEQ-UHFFFAOYSA-N
MW214.65 g/mol
LogP1.56
Rot. Bonds1

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

5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride (PubChem CID 122156783) has the molecular formula C9H11ClN2O2 and a molecular weight of 214.65 g/mol. Its IUPAC name is 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride
PubChem CID122156783
Molecular FormulaC9H11ClN2O2
Molecular Weight214.65 g/mol
Exact Mass214.05
IUPAC Name5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1ccc2c(n1)CCCN2
InChIInChI=1S/C9H10N2O2.ClH/c12-9(13)8-4-3-6-7(11-8)2-1-5-10-6;/h3-4,10H,1-2,5H2,(H,12,13);1H
InChIKeyHMSGDHBBKNUZEQ-UHFFFAOYSA-N
XLogP1.56
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.65
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride 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-1,5-naphthyridine-2-carboxylic acid;hydrochloride?
The IUPAC name of 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride (CID 122156783) is 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride?
The canonical SMILES for 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride is Cl.O=C(O)c1ccc2c(n1)CCCN2.
What is the InChIKey of 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride?
The InChIKey is HMSGDHBBKNUZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2.ClH/c12-9(13)8-4-3-6-7(11-8)2-1-5-10-6;/h3-4,10H,1-2,5H2,(H,12,13);1H.
What are the key properties of 5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride?
5,6,7,8-tetrahydro-1,5-naphthyridine-2-carboxylic acid;hydrochloride has a molecular weight of 214.65 g/mol, XLogP of 1.56, 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-1,5-naphthyridine-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 122156783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).