2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide

C13H8Cl2N4O — CID 167754132

IUPAC2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc2[nH]ncc2c1Cl)c1cccnc1Cl
InChIInChI=1S/C13H8Cl2N4O/c14-11-8-6-17-19-9(8)3-4-10(11)18-13(20)7-2-1-5-16-12(7)15/h1-6H,(H,17,19)(H,18,20)
InChIKeyPJLDRAPQXKWWFU-UHFFFAOYSA-N
MW307.14 g/mol
LogP3.52
Rot. Bonds2

About 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide

2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide (PubChem CID 167754132) has the molecular formula C13H8Cl2N4O and a molecular weight of 307.14 g/mol. Its IUPAC name is 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide
PubChem CID167754132
Molecular FormulaC13H8Cl2N4O
Molecular Weight307.14 g/mol
Exact Mass306.01
IUPAC Name2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc2[nH]ncc2c1Cl)c1cccnc1Cl
InChIInChI=1S/C13H8Cl2N4O/c14-11-8-6-17-19-9(8)3-4-10(11)18-13(20)7-2-1-5-16-12(7)15/h1-6H,(H,17,19)(H,18,20)
InChIKeyPJLDRAPQXKWWFU-UHFFFAOYSA-N
XLogP3.52
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.14
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-1H-indazol-5-yl)-2-(2-methoxyethoxy)pyridine-3-carboxamide
CID 166365276
3-acetamido-N-(4-chloro-1H-indazol-5-yl)pyridine-2-carboxamide
CID 167970294
N-(4-chloro-1H-indazol-5-yl)-3-methylsulfanylpyrazine-2-carboxamide
CID 167744320
N-(4-chloro-1H-indazol-5-yl)-2-(dimethylamino)pyridine-4-carboxamide
CID 167812323
2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide
CID 166365288
2-chloro-N-[2-(pyridin-3-ylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 30336522
2-chloro-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 9097781
N-(2-bromo-4-chlorophenyl)-2-chloropyridine-3-carboxamide
CID 81027409
N-(2-tert-butylphenyl)-2-chloropyridine-3-carboxamide
CID 60628052
2-chloro-N-(2-methoxy-4-methylphenyl)pyridine-3-carboxamide
CID 61042493
N-(2-chloro-3-pyridinyl)-2-(methylamino)benzamide
CID 61375906
methyl 2-[(2-chloropyridine-3-carbonyl)amino]benzoate
CID 4051547

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide?
The IUPAC name of 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide (CID 167754132) is 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide is O=C(Nc1ccc2[nH]ncc2c1Cl)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide?
The InChIKey is PJLDRAPQXKWWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2N4O/c14-11-8-6-17-19-9(8)3-4-10(11)18-13(20)7-2-1-5-16-12(7)15/h1-6H,(H,17,19)(H,18,20).
What are the key properties of 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide?
2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide has a molecular weight of 307.14 g/mol, XLogP of 3.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-chloro-1H-indazol-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 167754132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).