1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide

C18H13ClFN3O2 — CID 118039631

IUPAC1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide
SMILESO=C(NNc1ccc(F)cc1)c1ccc(=O)n(-c2cccc(Cl)c2)c1
InChIInChI=1S/C18H13ClFN3O2/c19-13-2-1-3-16(10-13)23-11-12(4-9-17(23)24)18(25)22-21-15-7-5-14(20)6-8-15/h1-11,21H,(H,22,25)
InChIKeyCQKZISPLUBPNFA-UHFFFAOYSA-N
MW357.77 g/mol
LogP3.39
Rot. Bonds4

About 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide

1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide (PubChem CID 118039631) has the molecular formula C18H13ClFN3O2 and a molecular weight of 357.77 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide
PubChem CID118039631
Molecular FormulaC18H13ClFN3O2
Molecular Weight357.77 g/mol
Exact Mass357.07
IUPAC Name1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide
SMILESO=C(NNc1ccc(F)cc1)c1ccc(=O)n(-c2cccc(Cl)c2)c1
InChIInChI=1S/C18H13ClFN3O2/c19-13-2-1-3-16(10-13)23-11-12(4-9-17(23)24)18(25)22-21-15-7-5-14(20)6-8-15/h1-11,21H,(H,22,25)
InChIKeyCQKZISPLUBPNFA-UHFFFAOYSA-N
XLogP3.39
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.77
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-fluorophenyl)-6-oxo-1-[4-(trifluoromethyl)phenyl]pyridine-3-carbohydrazide
CID 118039692
N'-(4-chloro-3-fluorophenyl)-1-methyl-6-oxopyridine-3-carbohydrazide
CID 118039643
1-[2-[4-(fluoromethyl)phenyl]-2-oxoethyl]-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide
CID 122632925
3-chloro-N'-[6-(4-fluoroanilino)-5-nitropyrimidin-4-yl]benzohydrazide
CID 22533304
1-[(3-chlorophenyl)methyl]-N-(3,4-difluorophenyl)-6-oxopyridine-3-carboxamide
CID 26844102
N-(3-chloro-4-fluorophenyl)-1-[(3-chlorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8697484
ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide
CID 142575628
1-benzyl-N'-(4-fluorobenzoyl)-6-oxopyridine-3-carbohydrazide
CID 27370694
1-(4-fluorophenyl)-N-[4-(1H-imidazol-5-yl)phenyl]-6-oxopyridine-3-carboxamide
CID 91955106
N-[(4S)-1-(3-chlorophenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-4-fluorobenzamide
CID 28947474
N-[4-chloro-2-(4-fluorobenzoyl)phenyl]-4-fluorobenzamide
CID 67505636
N'-(4-fluorophenyl)-4-(4-hydroxyphenoxy)benzohydrazide
CID 172676933

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide?
The IUPAC name of 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide (CID 118039631) is 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide.
What is the SMILES notation for 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide?
The canonical SMILES for 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide is O=C(NNc1ccc(F)cc1)c1ccc(=O)n(-c2cccc(Cl)c2)c1.
What is the InChIKey of 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide?
The InChIKey is CQKZISPLUBPNFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClFN3O2/c19-13-2-1-3-16(10-13)23-11-12(4-9-17(23)24)18(25)22-21-15-7-5-14(20)6-8-15/h1-11,21H,(H,22,25).
What are the key properties of 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide?
1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide has a molecular weight of 357.77 g/mol, XLogP of 3.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N'-(4-fluorophenyl)-6-oxopyridine-3-carbohydrazide is sourced from PubChem (CID 118039631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).