4-phenyl-1,2-dihydrophthalazine

C14H12N2 — CID 23498384

IUPAC4-phenyl-1,2-dihydrophthalazine
SMILESc1ccc(C2=NNCc3ccccc32)cc1
InChIInChI=1S/C14H12N2/c1-2-6-11(7-3-1)14-13-9-5-4-8-12(13)10-15-16-14/h1-9,15H,10H2
InChIKeyBFRXZYQEUAIZHD-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.54
Rot. Bonds1

About 4-phenyl-1,2-dihydrophthalazine

4-phenyl-1,2-dihydrophthalazine (PubChem CID 23498384) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-phenyl-1,2-dihydrophthalazine.

Molecular Properties

Compound Name4-phenyl-1,2-dihydrophthalazine
PubChem CID23498384
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name4-phenyl-1,2-dihydrophthalazine
SMILESc1ccc(C2=NNCc3ccccc32)cc1
InChIInChI=1S/C14H12N2/c1-2-6-11(7-3-1)14-13-9-5-4-8-12(13)10-15-16-14/h1-9,15H,10H2
InChIKeyBFRXZYQEUAIZHD-UHFFFAOYSA-N
XLogP2.54
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1,2-dihydrophthalazine?
The IUPAC name of 4-phenyl-1,2-dihydrophthalazine (CID 23498384) is 4-phenyl-1,2-dihydrophthalazine.
What is the SMILES notation for 4-phenyl-1,2-dihydrophthalazine?
The canonical SMILES for 4-phenyl-1,2-dihydrophthalazine is c1ccc(C2=NNCc3ccccc32)cc1.
What is the InChIKey of 4-phenyl-1,2-dihydrophthalazine?
The InChIKey is BFRXZYQEUAIZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c1-2-6-11(7-3-1)14-13-9-5-4-8-12(13)10-15-16-14/h1-9,15H,10H2.
What are the key properties of 4-phenyl-1,2-dihydrophthalazine?
4-phenyl-1,2-dihydrophthalazine has a molecular weight of 208.26 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1,2-dihydrophthalazine is sourced from PubChem (CID 23498384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).