4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide

C14H11ClF3N3O — CID 2805711

IUPAC4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide
SMILESCc1cc(C(F)(F)F)cc(NNC(=O)c2ccc(Cl)cc2)n1
InChIInChI=1S/C14H11ClF3N3O/c1-8-6-10(14(16,17)18)7-12(19-8)20-21-13(22)9-2-4-11(15)5-3-9/h2-7H,1H3,(H,19,20)(H,21,22)
InChIKeyONYCHFACZNULGS-UHFFFAOYSA-N
MW329.71 g/mol
LogP3.82
Rot. Bonds3

About 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide

4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide (PubChem CID 2805711) has the molecular formula C14H11ClF3N3O and a molecular weight of 329.71 g/mol. Its IUPAC name is 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide.

Molecular Properties

Compound Name4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide
PubChem CID2805711
Molecular FormulaC14H11ClF3N3O
Molecular Weight329.71 g/mol
Exact Mass329.05
IUPAC Name4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide
SMILESCc1cc(C(F)(F)F)cc(NNC(=O)c2ccc(Cl)cc2)n1
InChIInChI=1S/C14H11ClF3N3O/c1-8-6-10(14(16,17)18)7-12(19-8)20-21-13(22)9-2-4-11(15)5-3-9/h2-7H,1H3,(H,19,20)(H,21,22)
InChIKeyONYCHFACZNULGS-UHFFFAOYSA-N
XLogP3.82
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.71
LogP ≤ 53.82
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

4-methyl-N'-[6-phenyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide
CID 139224365
2,4-dichloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzenesulfonohydrazide
CID 2805713
3,4-dichloro-N'-[4-(trifluoromethyl)-2-pyridinyl]benzohydrazide
CID 599570
4-chloro-N'-(6-chloropyridazin-3-yl)benzohydrazide
CID 6401637
N-(4-chlorophenyl)-4-[6-(dimethylamino)-4-(trifluoromethyl)-2-pyridinyl]benzamide
CID 71628222
2-acetamido-N-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-6-methylpyridine-4-carboxamide
CID 67509549
N'-[5-amino-6-[4-(trifluoromethyl)anilino]pyrimidin-4-yl]-4-chlorobenzohydrazide
CID 19151006
4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N'-[4-(trifluoromethyl)benzoyl]benzohydrazide
CID 16546762
N'-(4,6-dimethylpyrimidin-2-yl)-4-(2,2,2-trifluoroethoxymethyl)benzohydrazide
CID 30341698
N'-(4-chlorobenzoyl)-2,4-dimethyl-1,3-thiazole-5-carbohydrazide
CID 2744486
4-chloro-N'-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]benzohydrazide
CID 40544516
N-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-methyl-6-(propanoylamino)pyridine-4-carboxamide
CID 67511343

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide?
The IUPAC name of 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide (CID 2805711) is 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide.
What is the SMILES notation for 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide?
The canonical SMILES for 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide is Cc1cc(C(F)(F)F)cc(NNC(=O)c2ccc(Cl)cc2)n1.
What is the InChIKey of 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide?
The InChIKey is ONYCHFACZNULGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF3N3O/c1-8-6-10(14(16,17)18)7-12(19-8)20-21-13(22)9-2-4-11(15)5-3-9/h2-7H,1H3,(H,19,20)(H,21,22).
What are the key properties of 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide?
4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide has a molecular weight of 329.71 g/mol, XLogP of 3.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N'-[6-methyl-4-(trifluoromethyl)-2-pyridinyl]benzohydrazide is sourced from PubChem (CID 2805711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).