[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine

C11H11Cl3N4 — CID 105338868

IUPAC[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine
SMILESCn1ncc(Cl)c1C(NN)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H11Cl3N4/c1-18-11(9(14)5-16-18)10(17-15)6-2-7(12)4-8(13)3-6/h2-5,10,17H,15H2,1H3
InChIKeyJALCZRJVIANUEQ-UHFFFAOYSA-N
MW305.60 g/mol
LogP2.93
Rot. Bonds3

About [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine

[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine (PubChem CID 105338868) has the molecular formula C11H11Cl3N4 and a molecular weight of 305.60 g/mol. Its IUPAC name is [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine
PubChem CID105338868
Molecular FormulaC11H11Cl3N4
Molecular Weight305.60 g/mol
Exact Mass304.00
IUPAC Name[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine
SMILESCn1ncc(Cl)c1C(NN)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C11H11Cl3N4/c1-18-11(9(14)5-16-18)10(17-15)6-2-7(12)4-8(13)3-6/h2-5,10,17H,15H2,1H3
InChIKeyJALCZRJVIANUEQ-UHFFFAOYSA-N
XLogP2.93
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.60
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine?
The IUPAC name of [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine (CID 105338868) is [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine is Cn1ncc(Cl)c1C(NN)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine?
The InChIKey is JALCZRJVIANUEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11Cl3N4/c1-18-11(9(14)5-16-18)10(17-15)6-2-7(12)4-8(13)3-6/h2-5,10,17H,15H2,1H3.
What are the key properties of [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine?
[(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine has a molecular weight of 305.60 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-methylpyrazol-5-yl)-(3,5-dichlorophenyl)methyl]hydrazine is sourced from PubChem (CID 105338868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).