(6-chloro-4-phenylphthalazin-1-yl)hydrazine

C14H11ClN4 — CID 21283331

IUPAC(6-chloro-4-phenylphthalazin-1-yl)hydrazine
SMILESNNc1nnc(-c2ccccc2)c2cc(Cl)ccc12
InChIInChI=1S/C14H11ClN4/c15-10-6-7-11-12(8-10)13(18-19-14(11)17-16)9-4-2-1-3-5-9/h1-8H,16H2,(H,17,19)
InChIKeyPTIIJXOOYMMFJB-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.24
Rot. Bonds2

About (6-chloro-4-phenylphthalazin-1-yl)hydrazine

(6-chloro-4-phenylphthalazin-1-yl)hydrazine (PubChem CID 21283331) has the molecular formula C14H11ClN4 and a molecular weight of 270.72 g/mol. Its IUPAC name is (6-chloro-4-phenylphthalazin-1-yl)hydrazine.

Molecular Properties

Compound Name(6-chloro-4-phenylphthalazin-1-yl)hydrazine
PubChem CID21283331
Molecular FormulaC14H11ClN4
Molecular Weight270.72 g/mol
Exact Mass270.07
IUPAC Name(6-chloro-4-phenylphthalazin-1-yl)hydrazine
SMILESNNc1nnc(-c2ccccc2)c2cc(Cl)ccc12
InChIInChI=1S/C14H11ClN4/c15-10-6-7-11-12(8-10)13(18-19-14(11)17-16)9-4-2-1-3-5-9/h1-8H,16H2,(H,17,19)
InChIKeyPTIIJXOOYMMFJB-UHFFFAOYSA-N
XLogP3.24
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.24
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 (6-chloro-4-phenylphthalazin-1-yl)hydrazine?
The IUPAC name of (6-chloro-4-phenylphthalazin-1-yl)hydrazine (CID 21283331) is (6-chloro-4-phenylphthalazin-1-yl)hydrazine.
What is the SMILES notation for (6-chloro-4-phenylphthalazin-1-yl)hydrazine?
The canonical SMILES for (6-chloro-4-phenylphthalazin-1-yl)hydrazine is NNc1nnc(-c2ccccc2)c2cc(Cl)ccc12.
What is the InChIKey of (6-chloro-4-phenylphthalazin-1-yl)hydrazine?
The InChIKey is PTIIJXOOYMMFJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN4/c15-10-6-7-11-12(8-10)13(18-19-14(11)17-16)9-4-2-1-3-5-9/h1-8H,16H2,(H,17,19).
What are the key properties of (6-chloro-4-phenylphthalazin-1-yl)hydrazine?
(6-chloro-4-phenylphthalazin-1-yl)hydrazine has a molecular weight of 270.72 g/mol, XLogP of 3.24, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-4-phenylphthalazin-1-yl)hydrazine is sourced from PubChem (CID 21283331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).