3,5-diphenyl-4,5-dihydro-1H-pyrazole

C15H14N2 — CID 3683844

IUPAC3,5-diphenyl-4,5-dihydro-1H-pyrazole
SMILESc1ccc(C2=NNC(c3ccccc3)C2)cc1
InChIInChI=1S/C15H14N2/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-10,14,16H,11H2
InChIKeyVJFQJTFADLQQNS-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.13
Rot. Bonds2

About 3,5-diphenyl-4,5-dihydro-1H-pyrazole

3,5-diphenyl-4,5-dihydro-1H-pyrazole (PubChem CID 3683844) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 3,5-diphenyl-4,5-dihydro-1H-pyrazole.

Molecular Properties

Compound Name3,5-diphenyl-4,5-dihydro-1H-pyrazole
PubChem CID3683844
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name3,5-diphenyl-4,5-dihydro-1H-pyrazole
SMILESc1ccc(C2=NNC(c3ccccc3)C2)cc1
InChIInChI=1S/C15H14N2/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-10,14,16H,11H2
InChIKeyVJFQJTFADLQQNS-UHFFFAOYSA-N
XLogP3.13
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-3,5-diphenyl-4,5-dihydro-1H-pyrazole
CID 10376837
5-Phenyl-4,5-dihydro-1H-pyrazole
CID 120841
4H-1,2,6-Thiadiazine, 2,3-dihydro-3,5-diphenyl-, 1,1-dioxide
CID 293583
5-(4-methylphenyl)-3-phenyl-4,5-dihydro-1H-pyrazole
CID 4738338
1H-Pyrazole, 5-(4-chlorophenyl)-4,5-dihydro-3-phenyl-
CID 4738347
5-(4-bromophenyl)-3-phenyl-4,5-dihydro-1H-pyrazole
CID 43147995
1H-Pyrazole, 3,5-bis(4-chlorophenyl)-4,5-dihydro-
CID 4738351
5-(4-chlorophenyl)-3-(4-fluorophenyl)-4,5-dihydro-1H-pyrazole
CID 127034566
3-Phenyl-4,5-dihydro-1H-pyrazole
CID 589745
3-(Biphenyl-4-yl)-5-phenyl-4,5-dihydro-1h-pyrazole
CID 23583181
5-(4-methylphenyl)-3-(4-phenylphenyl)-4,5-dihydro-1H-pyrazole
CID 24882538
3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazole
CID 45268669

Frequently Asked Questions

What is the IUPAC name of 3,5-diphenyl-4,5-dihydro-1H-pyrazole?
The IUPAC name of 3,5-diphenyl-4,5-dihydro-1H-pyrazole (CID 3683844) is 3,5-diphenyl-4,5-dihydro-1H-pyrazole.
What is the SMILES notation for 3,5-diphenyl-4,5-dihydro-1H-pyrazole?
The canonical SMILES for 3,5-diphenyl-4,5-dihydro-1H-pyrazole is c1ccc(C2=NNC(c3ccccc3)C2)cc1.
What is the InChIKey of 3,5-diphenyl-4,5-dihydro-1H-pyrazole?
The InChIKey is VJFQJTFADLQQNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-10,14,16H,11H2.
What are the key properties of 3,5-diphenyl-4,5-dihydro-1H-pyrazole?
3,5-diphenyl-4,5-dihydro-1H-pyrazole has a molecular weight of 222.29 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diphenyl-4,5-dihydro-1H-pyrazole is sourced from PubChem (CID 3683844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).