5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid

C12H10N4O3 — CID 104742707

IUPAC5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
SMILESNc1cccnc1C(=O)Nc1ccc(C(=O)O)nc1
InChIInChI=1S/C12H10N4O3/c13-8-2-1-5-14-10(8)11(17)16-7-3-4-9(12(18)19)15-6-7/h1-6H,13H2,(H,16,17)(H,18,19)
InChIKeyKALOJCLAJZPSJN-UHFFFAOYSA-N
MW258.24 g/mol
LogP1.01
Rot. Bonds3

About 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid

5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid (PubChem CID 104742707) has the molecular formula C12H10N4O3 and a molecular weight of 258.24 g/mol. Its IUPAC name is 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
PubChem CID104742707
Molecular FormulaC12H10N4O3
Molecular Weight258.24 g/mol
Exact Mass258.08
IUPAC Name5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid
SMILESNc1cccnc1C(=O)Nc1ccc(C(=O)O)nc1
InChIInChI=1S/C12H10N4O3/c13-8-2-1-5-14-10(8)11(17)16-7-3-4-9(12(18)19)15-6-7/h1-6H,13H2,(H,16,17)(H,18,19)
InChIKeyKALOJCLAJZPSJN-UHFFFAOYSA-N
XLogP1.01
TPSA118.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-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

Related Compounds

3-amino-N-[4-(carbamoylamino)phenyl]pyridine-2-carboxamide
CID 104741358
3-[(3-aminopyridine-2-carbonyl)amino]benzoic acid
CID 104741844
3-amino-N-(4-cyanophenyl)pyridine-2-carboxamide
CID 104740905
3-amino-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]pyridine-2-carboxamide
CID 104741251
3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-carboxamide
CID 104741943
2-[(3-aminopyridine-2-carbonyl)amino]benzoic acid
CID 104741859
3-amino-N-[4-(ethylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 104741386
5-acetamidopyridine-2-carboxylic acid
CID 5278292
4-[(3-aminopyridine-2-carbonyl)amino]-3,5-dichlorobenzoic acid
CID 104742777
3-amino-N-(1,3-benzodioxol-5-yl)pyridine-2-carboxamide
CID 104740959
5-[(5-chloropyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 107371641
N-(3-acetamido-4-fluorophenyl)-3-aminopyridine-2-carboxamide
CID 104741465

Frequently Asked Questions

What is the IUPAC name of 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid (CID 104742707) is 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid is Nc1cccnc1C(=O)Nc1ccc(C(=O)O)nc1.
What is the InChIKey of 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid?
The InChIKey is KALOJCLAJZPSJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O3/c13-8-2-1-5-14-10(8)11(17)16-7-3-4-9(12(18)19)15-6-7/h1-6H,13H2,(H,16,17)(H,18,19).
What are the key properties of 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid?
5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid has a molecular weight of 258.24 g/mol, XLogP of 1.01, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-aminopyridine-2-carbonyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 104742707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).