8-anilino-1,6-naphthyridine-2-carboxylic acid

C15H11N3O2 — CID 69101575

IUPAC8-anilino-1,6-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2cncc(Nc3ccccc3)c2n1
InChIInChI=1S/C15H11N3O2/c19-15(20)12-7-6-10-8-16-9-13(14(10)18-12)17-11-4-2-1-3-5-11/h1-9,17H,(H,19,20)
InChIKeyDJDMQMKLDYUOGF-UHFFFAOYSA-N
MW265.27 g/mol
LogP3.07
Rot. Bonds3

About 8-anilino-1,6-naphthyridine-2-carboxylic acid

8-anilino-1,6-naphthyridine-2-carboxylic acid (PubChem CID 69101575) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is 8-anilino-1,6-naphthyridine-2-carboxylic acid.

Molecular Properties

Compound Name8-anilino-1,6-naphthyridine-2-carboxylic acid
PubChem CID69101575
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Name8-anilino-1,6-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2cncc(Nc3ccccc3)c2n1
InChIInChI=1S/C15H11N3O2/c19-15(20)12-7-6-10-8-16-9-13(14(10)18-12)17-11-4-2-1-3-5-11/h1-9,17H,(H,19,20)
InChIKeyDJDMQMKLDYUOGF-UHFFFAOYSA-N
XLogP3.07
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-anilino-1,6-naphthyridine-2-carboxylic acid?
The IUPAC name of 8-anilino-1,6-naphthyridine-2-carboxylic acid (CID 69101575) is 8-anilino-1,6-naphthyridine-2-carboxylic acid.
What is the SMILES notation for 8-anilino-1,6-naphthyridine-2-carboxylic acid?
The canonical SMILES for 8-anilino-1,6-naphthyridine-2-carboxylic acid is O=C(O)c1ccc2cncc(Nc3ccccc3)c2n1.
What is the InChIKey of 8-anilino-1,6-naphthyridine-2-carboxylic acid?
The InChIKey is DJDMQMKLDYUOGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c19-15(20)12-7-6-10-8-16-9-13(14(10)18-12)17-11-4-2-1-3-5-11/h1-9,17H,(H,19,20).
What are the key properties of 8-anilino-1,6-naphthyridine-2-carboxylic acid?
8-anilino-1,6-naphthyridine-2-carboxylic acid has a molecular weight of 265.27 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-anilino-1,6-naphthyridine-2-carboxylic acid is sourced from PubChem (CID 69101575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).