2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine

C24H19ClF3N5 — CID 143380298

IUPAC2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
SMILESCN(Cc1ccc(C(F)(F)F)nc1)Nc1nccc(-c2ccc(Cl)cc2)c1-c1ccncc1
InChIInChI=1S/C24H19ClF3N5/c1-33(15-16-2-7-21(31-14-16)24(26,27)28)32-23-22(18-8-11-29-12-9-18)20(10-13-30-23)17-3-5-19(25)6-4-17/h2-14H,15H2,1H3,(H,30,32)
InChIKeyKESNSCHCGKFFSD-UHFFFAOYSA-N
MW469.90 g/mol
LogP6.34
Rot. Bonds6

About 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine

2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine (PubChem CID 143380298) has the molecular formula C24H19ClF3N5 and a molecular weight of 469.90 g/mol. Its IUPAC name is 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine.

Molecular Properties

Compound Name2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
PubChem CID143380298
Molecular FormulaC24H19ClF3N5
Molecular Weight469.90 g/mol
Exact Mass469.13
IUPAC Name2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
SMILESCN(Cc1ccc(C(F)(F)F)nc1)Nc1nccc(-c2ccc(Cl)cc2)c1-c1ccncc1
InChIInChI=1S/C24H19ClF3N5/c1-33(15-16-2-7-21(31-14-16)24(26,27)28)32-23-22(18-8-11-29-12-9-18)20(10-13-30-23)17-3-5-19(25)6-4-17/h2-14H,15H2,1H3,(H,30,32)
InChIKeyKESNSCHCGKFFSD-UHFFFAOYSA-N
XLogP6.34
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.90
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine with MolForge

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Related Compounds

(6Z)-4-(4-chlorophenyl)-6-[methyl-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazinylidene]-5-pyridin-4-ylpyridazine-1-carbaldehyde
CID 143072026
5-pyridin-4-yl-2-(trifluoromethyl)pyridine
CID 46316298
7-(4-chlorophenyl)-6-methoxy-8-pyridin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 72792900
7-(4-chlorophenyl)-8-pyrimidin-4-yl-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 71099511
5-(4-pyridin-4-yl-1H-pyrazol-5-yl)-2-(trifluoromethyl)pyridine
CID 3694575
7-chloro-8-(4-chlorophenyl)-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
CID 69064913
7-(4-chlorophenyl)-8-[4-(N-hydroxy-C-methylcarbonimidoyl)phenyl]-2-[[6-(trifluoromethyl)-3-pyridinyl]methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
CID 73218668
(6Z)-2-(azetidin-1-yl)-4-(4-chlorophenyl)-5-(4-methylphenyl)-6-[methyl-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazinylidene]pyrimidine-1-carbaldehyde
CID 143380380
7,8-bis(4-chlorophenyl)-6-[[6-(trifluoromethyl)-3-pyridinyl]methoxy]-[1,2,4]triazolo[4,3-b]pyridazine
CID 11990288
5-(fluoromethyl)-2-(trifluoromethyl)pyridine
CID 177038549
7-(4-chlorophenyl)-8-pyridin-4-yl-2-[[4-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 11988751
N-[[5-(4-chlorophenyl)-4-pyridin-4-ylpyridazin-3-yl]amino]formamide
CID 143072017

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
The IUPAC name of 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine (CID 143380298) is 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine.
What is the SMILES notation for 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
The canonical SMILES for 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine is CN(Cc1ccc(C(F)(F)F)nc1)Nc1nccc(-c2ccc(Cl)cc2)c1-c1ccncc1.
What is the InChIKey of 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
The InChIKey is KESNSCHCGKFFSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClF3N5/c1-33(15-16-2-7-21(31-14-16)24(26,27)28)32-23-22(18-8-11-29-12-9-18)20(10-13-30-23)17-3-5-19(25)6-4-17/h2-14H,15H2,1H3,(H,30,32).
What are the key properties of 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine?
2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine has a molecular weight of 469.90 g/mol, XLogP of 6.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-chlorophenyl)-3-pyridin-4-yl-2-pyridinyl]-1-methyl-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine is sourced from PubChem (CID 143380298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).