3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide

C12H8ClF3N4O — CID 62237965

IUPAC3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
SMILESNNc1ccc(Cl)c(C(=O)Nc2ccc(F)c(F)c2F)n1
InChIInChI=1S/C12H8ClF3N4O/c13-5-1-4-8(20-17)19-11(5)12(21)18-7-3-2-6(14)9(15)10(7)16/h1-4H,17H2,(H,18,21)(H,19,20)
InChIKeyNWPBGTDQKRNYFR-UHFFFAOYSA-N
MW316.67 g/mol
LogP2.69
Rot. Bonds3

About 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide

3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide (PubChem CID 62237965) has the molecular formula C12H8ClF3N4O and a molecular weight of 316.67 g/mol. Its IUPAC name is 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
PubChem CID62237965
Molecular FormulaC12H8ClF3N4O
Molecular Weight316.67 g/mol
Exact Mass316.03
IUPAC Name3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
SMILESNNc1ccc(Cl)c(C(=O)Nc2ccc(F)c(F)c2F)n1
InChIInChI=1S/C12H8ClF3N4O/c13-5-1-4-8(20-17)19-11(5)12(21)18-7-3-2-6(14)9(15)10(7)16/h1-4H,17H2,(H,18,21)(H,19,20)
InChIKeyNWPBGTDQKRNYFR-UHFFFAOYSA-N
XLogP2.69
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.67
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'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
6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 62237786
N-(4-bromo-2,3-dichlorophenyl)-3-chloro-6-hydrazinylpyridine-2-carboxamide
CID 107793936
3-chloro-N-(4-fluoro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62812279
3-chloro-N-(3,4-dichlorophenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62235808
2,6-dichloro-N-(2,3,4-trifluorophenyl)pyridine-3-carboxamide
CID 52762530
3-chloro-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62235822
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62237587
3-chloro-6-hydrazinyl-N-pyridazin-3-ylpyridine-2-carboxamide
CID 116788097
3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62186223
3-chloro-N-(2-fluoro-5-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62165789

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide (CID 62237965) is 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide is NNc1ccc(Cl)c(C(=O)Nc2ccc(F)c(F)c2F)n1.
What is the InChIKey of 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide?
The InChIKey is NWPBGTDQKRNYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClF3N4O/c13-5-1-4-8(20-17)19-11(5)12(21)18-7-3-2-6(14)9(15)10(7)16/h1-4H,17H2,(H,18,21)(H,19,20).
What are the key properties of 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide?
3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide has a molecular weight of 316.67 g/mol, XLogP of 2.69, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-hydrazinyl-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62237965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).