4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid

C11H7Cl2N3O2 — CID 22677268

IUPAC4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid
SMILESNc1cc(-c2ccc(Cl)nc2)nc(C(=O)O)c1Cl
InChIInChI=1S/C11H7Cl2N3O2/c12-8-2-1-5(4-15-8)7-3-6(14)9(13)10(16-7)11(17)18/h1-4H,(H2,14,16)(H,17,18)
InChIKeyVTUWKOXCVAMCNP-UHFFFAOYSA-N
MW284.10 g/mol
LogP2.73
Rot. Bonds2

About 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid

4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid (PubChem CID 22677268) has the molecular formula C11H7Cl2N3O2 and a molecular weight of 284.10 g/mol. Its IUPAC name is 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid
PubChem CID22677268
Molecular FormulaC11H7Cl2N3O2
Molecular Weight284.10 g/mol
Exact Mass282.99
IUPAC Name4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid
SMILESNc1cc(-c2ccc(Cl)nc2)nc(C(=O)O)c1Cl
InChIInChI=1S/C11H7Cl2N3O2/c12-8-2-1-5(4-15-8)7-3-6(14)9(13)10(16-7)11(17)18/h1-4H,(H2,14,16)(H,17,18)
InChIKeyVTUWKOXCVAMCNP-UHFFFAOYSA-N
XLogP2.73
TPSA89.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.10
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)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

methyl 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylate
CID 22677295
4-amino-3-chloro-6-[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]pyridine-2-carboxylic acid
CID 174443473
4-amino-3-chloro-6-(4-chloro-3-fluorophenyl)pyridine-2-carboxylic acid
CID 22677438
4-amino-3-chloro-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 22677423
4-amino-3-chloro-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2-carboxylic acid
CID 123931312
4-amino-6-[3,4-bis[fluoro(dihydroxy)methyl]phenyl]-3-chloropyridine-2-carboxylic acid
CID 68598493
4-amino-3-chloro-6-[3-fluoro-4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
CID 90440337
4-amino-3-fluoro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylic acid
CID 151240746
4-amino-3-chloro-6-[4-methyl-3-(sulfomethyl)phenyl]pyridine-2-carboxylic acid
CID 151134828
4-amino-3-chloro-6-(2-methylpyrazol-3-yl)pyridine-2-carboxylic acid
CID 22677351
3-amino-5-(4-chlorophenyl)pyridine-2-carboxylic acid
CID 115046366
4-amino-3-chloro-6-(2,4-difluoro-3-methylphenyl)pyridine-2-carboxylic acid
CID 68598483

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid?
The IUPAC name of 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid (CID 22677268) is 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid?
The canonical SMILES for 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid is Nc1cc(-c2ccc(Cl)nc2)nc(C(=O)O)c1Cl.
What is the InChIKey of 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid?
The InChIKey is VTUWKOXCVAMCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Cl2N3O2/c12-8-2-1-5(4-15-8)7-3-6(14)9(13)10(16-7)11(17)18/h1-4H,(H2,14,16)(H,17,18).
What are the key properties of 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid?
4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid has a molecular weight of 284.10 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-chloro-6-(6-chloro-3-pyridinyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 22677268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).