N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide

C12H8Cl3N3O — CID 47099649

IUPACN'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
SMILESO=C(NNc1c(Cl)cc(Cl)cc1Cl)c1cccnc1
InChIInChI=1S/C12H8Cl3N3O/c13-8-4-9(14)11(10(15)5-8)17-18-12(19)7-2-1-3-16-6-7/h1-6,17H,(H,18,19)
InChIKeyUUKPVHAGZRXKEL-UHFFFAOYSA-N
MW316.58 g/mol
LogP3.80
Rot. Bonds3

About N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide

N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide (PubChem CID 47099649) has the molecular formula C12H8Cl3N3O and a molecular weight of 316.58 g/mol. Its IUPAC name is N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
PubChem CID47099649
Molecular FormulaC12H8Cl3N3O
Molecular Weight316.58 g/mol
Exact Mass314.97
IUPAC NameN'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
SMILESO=C(NNc1c(Cl)cc(Cl)cc1Cl)c1cccnc1
InChIInChI=1S/C12H8Cl3N3O/c13-8-4-9(14)11(10(15)5-8)17-18-12(19)7-2-1-3-16-6-7/h1-6,17H,(H,18,19)
InChIKeyUUKPVHAGZRXKEL-UHFFFAOYSA-N
XLogP3.80
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.58
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4,6-dichlorophenyl)pyridine-3-carboxamide
CID 16776804
3-methoxy-N'-(2,4,6-trichlorophenyl)benzohydrazide
CID 794857
N-(2-chloro-4-hydroxyphenyl)pyridine-3-carboxamide
CID 64787918
2-chloro-N'-(2,4,6-trichlorophenyl)benzohydrazide
CID 3981550
N-(2,4-dichlorophenyl)-4-oxo-4-[2-(pyridine-3-carbonyl)hydrazinyl]butanamide
CID 4922776
N'-(4-chloro-2-iodobenzoyl)pyridine-3-carbohydrazide
CID 39716932
2,2-dimethyl-N-[3-[(2,4,6-trichloroanilino)carbamoyl]phenyl]propanamide
CID 35185117
N'-pyridin-2-ylpyridine-3-carbohydrazide
CID 69416476
N'-[5-amino-6-[2-(pyridine-3-carbonyl)hydrazinyl]pyrimidin-4-yl]pyridine-3-carbohydrazide
CID 19151889
N-[2-(2,4-dichlorophenyl)ethyl]pyridine-3-carboxamide
CID 17472910
2-methoxy-N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide
CID 134062108
N-[2-[[2-(butanoylamino)-3,5-dichlorobenzoyl]amino]ethyl]pyridine-3-carboxamide
CID 55963098

Frequently Asked Questions

What is the IUPAC name of N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
The IUPAC name of N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide (CID 47099649) is N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide.
What is the SMILES notation for N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
The canonical SMILES for N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide is O=C(NNc1c(Cl)cc(Cl)cc1Cl)c1cccnc1.
What is the InChIKey of N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
The InChIKey is UUKPVHAGZRXKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl3N3O/c13-8-4-9(14)11(10(15)5-8)17-18-12(19)7-2-1-3-16-6-7/h1-6,17H,(H,18,19).
What are the key properties of N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide?
N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide has a molecular weight of 316.58 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,4,6-trichlorophenyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 47099649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).