3,5-diphenylpyrazol-1-amine

C15H13N3 — CID 13483634

IUPAC3,5-diphenylpyrazol-1-amine
SMILESNn1nc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C15H13N3/c16-18-15(13-9-5-2-6-10-13)11-14(17-18)12-7-3-1-4-8-12/h1-11H,16H2
InChIKeyCPHOVFKPVCTKKX-UHFFFAOYSA-N
MW235.29 g/mol
LogP2.93
Rot. Bonds2

About 3,5-diphenylpyrazol-1-amine

3,5-diphenylpyrazol-1-amine (PubChem CID 13483634) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 3,5-diphenylpyrazol-1-amine.

Molecular Properties

Compound Name3,5-diphenylpyrazol-1-amine
PubChem CID13483634
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name3,5-diphenylpyrazol-1-amine
SMILESNn1nc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C15H13N3/c16-18-15(13-9-5-2-6-10-13)11-14(17-18)12-7-3-1-4-8-12/h1-11H,16H2
InChIKeyCPHOVFKPVCTKKX-UHFFFAOYSA-N
XLogP2.93
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-diphenylpyrazol-1-amine?
The IUPAC name of 3,5-diphenylpyrazol-1-amine (CID 13483634) is 3,5-diphenylpyrazol-1-amine.
What is the SMILES notation for 3,5-diphenylpyrazol-1-amine?
The canonical SMILES for 3,5-diphenylpyrazol-1-amine is Nn1nc(-c2ccccc2)cc1-c1ccccc1.
What is the InChIKey of 3,5-diphenylpyrazol-1-amine?
The InChIKey is CPHOVFKPVCTKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c16-18-15(13-9-5-2-6-10-13)11-14(17-18)12-7-3-1-4-8-12/h1-11H,16H2.
What are the key properties of 3,5-diphenylpyrazol-1-amine?
3,5-diphenylpyrazol-1-amine has a molecular weight of 235.29 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diphenylpyrazol-1-amine is sourced from PubChem (CID 13483634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).