5-acetamido-6-aminopyridine-2-carboxylic acid

C8H9N3O3 — CID 5278294

IUPAC5-acetamido-6-aminopyridine-2-carboxylic acid
SMILESCC(=O)Nc1ccc(C(=O)O)nc1N
InChIInChI=1S/C8H9N3O3/c1-4(12)10-5-2-3-6(8(13)14)11-7(5)9/h2-3H,1H3,(H2,9,11)(H,10,12)(H,13,14)
InChIKeyKPAKLTBYPQSGHN-UHFFFAOYSA-N
MW195.18 g/mol
LogP0.32
Rot. Bonds2

About 5-acetamido-6-aminopyridine-2-carboxylic acid

5-acetamido-6-aminopyridine-2-carboxylic acid (PubChem CID 5278294) has the molecular formula C8H9N3O3 and a molecular weight of 195.18 g/mol. Its IUPAC name is 5-acetamido-6-aminopyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-acetamido-6-aminopyridine-2-carboxylic acid
PubChem CID5278294
Molecular FormulaC8H9N3O3
Molecular Weight195.18 g/mol
Exact Mass195.06
IUPAC Name5-acetamido-6-aminopyridine-2-carboxylic acid
SMILESCC(=O)Nc1ccc(C(=O)O)nc1N
InChIInChI=1S/C8H9N3O3/c1-4(12)10-5-2-3-6(8(13)14)11-7(5)9/h2-3H,1H3,(H2,9,11)(H,10,12)(H,13,14)
InChIKeyKPAKLTBYPQSGHN-UHFFFAOYSA-N
XLogP0.32
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.18
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-Acetamidopicolinic acid
CID 824640
5-Acetamidopyridine-2-carboxylic acid
CID 5278292
6-Aminopyridine-2-carboxylic acid
CID 351652
5-Acetamido-6-guanidino-pyridine-2-carboxylic acid
CID 5278295
5-Acetamido-4-amino-6-guanidino-pyridine-2-carboxylic acid
CID 5278298
6Acrylamidopicolinic acid
CID 63642220
4,6-Diamino-5-(methanesulfonamido)pyridine-2-carboxylic acid
CID 5278297
2-Pyridinecarboxylic acid, 5-[(1-oxopropyl)amino]-
CID 12640221
Methyl 5,6-diamino-2-pyridinecarboxylate
CID 12097747
6-(((Tert-butoxy)carbonyl)amino)pyridine-2-carboxylic acid
CID 22726931
3-Bromo-6-acetamidopyridine-2-carboxylic acid
CID 25306988
5,6-Diaminopyridine-2-carboxylic acid
CID 28330517

Frequently Asked Questions

What is the IUPAC name of 5-acetamido-6-aminopyridine-2-carboxylic acid?
The IUPAC name of 5-acetamido-6-aminopyridine-2-carboxylic acid (CID 5278294) is 5-acetamido-6-aminopyridine-2-carboxylic acid.
What is the SMILES notation for 5-acetamido-6-aminopyridine-2-carboxylic acid?
The canonical SMILES for 5-acetamido-6-aminopyridine-2-carboxylic acid is CC(=O)Nc1ccc(C(=O)O)nc1N.
What is the InChIKey of 5-acetamido-6-aminopyridine-2-carboxylic acid?
The InChIKey is KPAKLTBYPQSGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O3/c1-4(12)10-5-2-3-6(8(13)14)11-7(5)9/h2-3H,1H3,(H2,9,11)(H,10,12)(H,13,14).
What are the key properties of 5-acetamido-6-aminopyridine-2-carboxylic acid?
5-acetamido-6-aminopyridine-2-carboxylic acid has a molecular weight of 195.18 g/mol, XLogP of 0.32, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetamido-6-aminopyridine-2-carboxylic acid is sourced from PubChem (CID 5278294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).