3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide

C12H9Cl3N4O — CID 62235808

IUPAC3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide
SMILESNNc1ccc(Cl)c(C(=O)Nc2ccc(Cl)c(Cl)c2)n1
InChIInChI=1S/C12H9Cl3N4O/c13-7-2-1-6(5-9(7)15)17-12(20)11-8(14)3-4-10(18-11)19-16/h1-5H,16H2,(H,17,20)(H,18,19)
InChIKeySQAOYSFJOFCPMT-UHFFFAOYSA-N
MW331.59 g/mol
LogP3.58
Rot. Bonds3

About 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide

3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide (PubChem CID 62235808) has the molecular formula C12H9Cl3N4O and a molecular weight of 331.59 g/mol. Its IUPAC name is 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide
PubChem CID62235808
Molecular FormulaC12H9Cl3N4O
Molecular Weight331.59 g/mol
Exact Mass329.98
IUPAC Name3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide
SMILESNNc1ccc(Cl)c(C(=O)Nc2ccc(Cl)c(Cl)c2)n1
InChIInChI=1S/C12H9Cl3N4O/c13-7-2-1-6(5-9(7)15)17-12(20)11-8(14)3-4-10(18-11)19-16/h1-5H,16H2,(H,17,20)(H,18,19)
InChIKeySQAOYSFJOFCPMT-UHFFFAOYSA-N
XLogP3.58
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.59
LogP ≤ 53.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

3-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 107578975
3-chloro-N-(3,4-difluorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62247567
3-chloro-N-(4-fluoro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62812279
3-chloro-N-[3-(dimethylamino)phenyl]-6-hydrazinylpyridine-2-carboxamide
CID 115379438
3-chloro-N-(4-ethoxyphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62233417
N-(3,4-dichlorophenyl)-4-hydrazinylbenzamide
CID 62235810
3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide
CID 116788097
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62237587
3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 62237965
N-(4-bromo-2,3-dichlorophenyl)-3-chloro-6-hydrazinylpyridine-2-carboxamide
CID 107793936
3-chloro-N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62173294
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-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide (CID 62235808) is 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide is NNc1ccc(Cl)c(C(=O)Nc2ccc(Cl)c(Cl)c2)n1.
What is the InChIKey of 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide?
The InChIKey is SQAOYSFJOFCPMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl3N4O/c13-7-2-1-6(5-9(7)15)17-12(20)11-8(14)3-4-10(18-11)19-16/h1-5H,16H2,(H,17,20)(H,18,19).
What are the key properties of 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide?
3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide has a molecular weight of 331.59 g/mol, XLogP of 3.58, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide is sourced from PubChem (CID 62235808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).