5-methyl-2,3-diphenyl-3,4-dihydropyrazole

C16H16N2 — CID 616784

IUPAC5-methyl-2,3-diphenyl-3,4-dihydropyrazole
SMILESCC1=NN(c2ccccc2)C(c2ccccc2)C1
InChIInChI=1S/C16H16N2/c1-13-12-16(14-8-4-2-5-9-14)18(17-13)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3
InChIKeyFZTOIOYDPXSQDM-UHFFFAOYSA-N
MW236.32 g/mol
LogP4.01
Rot. Bonds2

About 5-methyl-2,3-diphenyl-3,4-dihydropyrazole

5-methyl-2,3-diphenyl-3,4-dihydropyrazole (PubChem CID 616784) has the molecular formula C16H16N2 and a molecular weight of 236.32 g/mol. Its IUPAC name is 5-methyl-2,3-diphenyl-3,4-dihydropyrazole.

Molecular Properties

Compound Name5-methyl-2,3-diphenyl-3,4-dihydropyrazole
PubChem CID616784
Molecular FormulaC16H16N2
Molecular Weight236.32 g/mol
Exact Mass236.13
IUPAC Name5-methyl-2,3-diphenyl-3,4-dihydropyrazole
SMILESCC1=NN(c2ccccc2)C(c2ccccc2)C1
InChIInChI=1S/C16H16N2/c1-13-12-16(14-8-4-2-5-9-14)18(17-13)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3
InChIKeyFZTOIOYDPXSQDM-UHFFFAOYSA-N
XLogP4.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
The IUPAC name of 5-methyl-2,3-diphenyl-3,4-dihydropyrazole (CID 616784) is 5-methyl-2,3-diphenyl-3,4-dihydropyrazole.
What is the SMILES notation for 5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
The canonical SMILES for 5-methyl-2,3-diphenyl-3,4-dihydropyrazole is CC1=NN(c2ccccc2)C(c2ccccc2)C1.
What is the InChIKey of 5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
The InChIKey is FZTOIOYDPXSQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2/c1-13-12-16(14-8-4-2-5-9-14)18(17-13)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3.
What are the key properties of 5-methyl-2,3-diphenyl-3,4-dihydropyrazole?
5-methyl-2,3-diphenyl-3,4-dihydropyrazole has a molecular weight of 236.32 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3-diphenyl-3,4-dihydropyrazole is sourced from PubChem (CID 616784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).