8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid

C14H10N4O2 — CID 69101150

IUPAC8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2cncc(Nc3ccncc3)c2n1
InChIInChI=1S/C14H10N4O2/c19-14(20)11-2-1-9-7-16-8-12(13(9)18-11)17-10-3-5-15-6-4-10/h1-8H,(H,15,17)(H,19,20)
InChIKeyQIABXANWQKVIHM-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.47
Rot. Bonds3

About 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid

8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid (PubChem CID 69101150) has the molecular formula C14H10N4O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid.

Molecular Properties

Compound Name8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid
PubChem CID69101150
Molecular FormulaC14H10N4O2
Molecular Weight266.26 g/mol
Exact Mass266.08
IUPAC Name8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2cncc(Nc3ccncc3)c2n1
InChIInChI=1S/C14H10N4O2/c19-14(20)11-2-1-9-7-16-8-12(13(9)18-11)17-10-3-5-15-6-4-10/h1-8H,(H,15,17)(H,19,20)
InChIKeyQIABXANWQKVIHM-UHFFFAOYSA-N
XLogP2.47
TPSA88.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid?
The IUPAC name of 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid (CID 69101150) is 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid.
What is the SMILES notation for 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid?
The canonical SMILES for 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid is O=C(O)c1ccc2cncc(Nc3ccncc3)c2n1.
What is the InChIKey of 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid?
The InChIKey is QIABXANWQKVIHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4O2/c19-14(20)11-2-1-9-7-16-8-12(13(9)18-11)17-10-3-5-15-6-4-10/h1-8H,(H,15,17)(H,19,20).
What are the key properties of 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid?
8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid has a molecular weight of 266.26 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(pyridin-4-ylamino)-1,6-naphthyridine-2-carboxylic acid is sourced from PubChem (CID 69101150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).