1,6-naphthyridine-2-carboxylic acid;hydrochloride

C9H7ClN2O2 — CID 170943375

IUPAC1,6-naphthyridine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1ccc2cnccc2n1
InChIInChI=1S/C9H6N2O2.ClH/c12-9(13)8-2-1-6-5-10-4-3-7(6)11-8;/h1-5H,(H,12,13);1H
InChIKeyGVMOASLSDILEQA-UHFFFAOYSA-N
MW210.62 g/mol
LogP1.75
Rot. Bonds1

About 1,6-naphthyridine-2-carboxylic acid;hydrochloride

1,6-naphthyridine-2-carboxylic acid;hydrochloride (PubChem CID 170943375) has the molecular formula C9H7ClN2O2 and a molecular weight of 210.62 g/mol. Its IUPAC name is 1,6-naphthyridine-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name1,6-naphthyridine-2-carboxylic acid;hydrochloride
PubChem CID170943375
Molecular FormulaC9H7ClN2O2
Molecular Weight210.62 g/mol
Exact Mass210.02
IUPAC Name1,6-naphthyridine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)c1ccc2cnccc2n1
InChIInChI=1S/C9H6N2O2.ClH/c12-9(13)8-2-1-6-5-10-4-3-7(6)11-8;/h1-5H,(H,12,13);1H
InChIKeyGVMOASLSDILEQA-UHFFFAOYSA-N
XLogP1.75
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.62
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,6-naphthyridine-2-carboxylic acid;hydrochloride?
The IUPAC name of 1,6-naphthyridine-2-carboxylic acid;hydrochloride (CID 170943375) is 1,6-naphthyridine-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 1,6-naphthyridine-2-carboxylic acid;hydrochloride?
The canonical SMILES for 1,6-naphthyridine-2-carboxylic acid;hydrochloride is Cl.O=C(O)c1ccc2cnccc2n1.
What is the InChIKey of 1,6-naphthyridine-2-carboxylic acid;hydrochloride?
The InChIKey is GVMOASLSDILEQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N2O2.ClH/c12-9(13)8-2-1-6-5-10-4-3-7(6)11-8;/h1-5H,(H,12,13);1H.
What are the key properties of 1,6-naphthyridine-2-carboxylic acid;hydrochloride?
1,6-naphthyridine-2-carboxylic acid;hydrochloride has a molecular weight of 210.62 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-naphthyridine-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 170943375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).