3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide

C10H9ClN6O — CID 116788097

IUPAC3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide
SMILESNNc1ccc(Cl)c(C(=O)Nc2cccnn2)n1
InChIInChI=1S/C10H9ClN6O/c11-6-3-4-7(16-12)14-9(6)10(18)15-8-2-1-5-13-17-8/h1-5H,12H2,(H,14,16)(H,15,17,18)
InChIKeyHSAOKAMBSZIRIU-UHFFFAOYSA-N
MW264.68 g/mol
LogP1.06
Rot. Bonds3

About 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide

3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide (PubChem CID 116788097) has the molecular formula C10H9ClN6O and a molecular weight of 264.68 g/mol. Its IUPAC name is 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide
PubChem CID116788097
Molecular FormulaC10H9ClN6O
Molecular Weight264.68 g/mol
Exact Mass264.05
IUPAC Name3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide
SMILESNNc1ccc(Cl)c(C(=O)Nc2cccnn2)n1
InChIInChI=1S/C10H9ClN6O/c11-6-3-4-7(16-12)14-9(6)10(18)15-8-2-1-5-13-17-8/h1-5H,12H2,(H,14,16)(H,15,17,18)
InChIKeyHSAOKAMBSZIRIU-UHFFFAOYSA-N
XLogP1.06
TPSA105.82 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.68
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-chloro-N-pyridazin-3-ylbenzamide
CID 116786031
3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62235808
2-amino-6-chloro-N-pyridazin-3-ylbenzamide
CID 116785965
3-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 107578975
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62237587
2-amino-N-pyridazin-3-yl-1,3-thiazole-4-carboxamide
CID 116786705
N-(4-bromo-2,3-dichlorophenyl)-3-chloro-6-hydrazinylpyridine-2-carboxamide
CID 107793936
3-chloro-N-(3,4-difluorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62247567
3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 62237965
pyridazin-3-ylurea
CID 13080987
3-chloro-N-[3-(dimethylamino)phenyl]-6-hydrazinylpyridine-2-carboxamide
CID 115379438
3-chloro-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62235822

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide (CID 116788097) is 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide is NNc1ccc(Cl)c(C(=O)Nc2cccnn2)n1.
What is the InChIKey of 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide?
The InChIKey is HSAOKAMBSZIRIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN6O/c11-6-3-4-7(16-12)14-9(6)10(18)15-8-2-1-5-13-17-8/h1-5H,12H2,(H,14,16)(H,15,17,18).
What are the key properties of 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide?
3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide has a molecular weight of 264.68 g/mol, XLogP of 1.06, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide is sourced from PubChem (CID 116788097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).