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

C16H15N3O — CID 175059714

IUPAC2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide
SMILESNC(=O)C1CC(c2ccccc2)=NN1c1ccccc1
InChIInChI=1S/C16H15N3O/c17-16(20)15-11-14(12-7-3-1-4-8-12)18-19(15)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,17,20)
InChIKeyYXRYKOFBAFHOOE-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.15
Rot. Bonds3

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

2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide (PubChem CID 175059714) has the molecular formula C16H15N3O and a molecular weight of 265.32 g/mol. Its IUPAC name is 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide.

Molecular Properties

Compound Name2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide
PubChem CID175059714
Molecular FormulaC16H15N3O
Molecular Weight265.32 g/mol
Exact Mass265.12
IUPAC Name2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide
SMILESNC(=O)C1CC(c2ccccc2)=NN1c1ccccc1
InChIInChI=1S/C16H15N3O/c17-16(20)15-11-14(12-7-3-1-4-8-12)18-19(15)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,17,20)
InChIKeyYXRYKOFBAFHOOE-UHFFFAOYSA-N
XLogP2.15
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide?
The IUPAC name of 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide (CID 175059714) is 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide.
What is the SMILES notation for 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide?
The canonical SMILES for 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide is NC(=O)C1CC(c2ccccc2)=NN1c1ccccc1.
What is the InChIKey of 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide?
The InChIKey is YXRYKOFBAFHOOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O/c17-16(20)15-11-14(12-7-3-1-4-8-12)18-19(15)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,17,20).
What are the key properties of 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide?
2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diphenyl-3,4-dihydropyrazole-3-carboxamide is sourced from PubChem (CID 175059714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).