3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol

C18H14N4O — CID 135857318

IUPAC3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol
SMILESOc1c(-c2ccccc2)n[nH]c1-c1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C18H14N4O/c23-17-15(13-9-5-2-6-10-13)21-22-16(17)18-19-11-14(20-18)12-7-3-1-4-8-12/h1-11,23H,(H,19,20)(H,21,22)
InChIKeyPBIQPUFDXFEYEP-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.84
Rot. Bonds3

About 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol

3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol (PubChem CID 135857318) has the molecular formula C18H14N4O and a molecular weight of 302.34 g/mol. Its IUPAC name is 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol.

Molecular Properties

Compound Name3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol
PubChem CID135857318
Molecular FormulaC18H14N4O
Molecular Weight302.34 g/mol
Exact Mass302.12
IUPAC Name3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol
SMILESOc1c(-c2ccccc2)n[nH]c1-c1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C18H14N4O/c23-17-15(13-9-5-2-6-10-13)21-22-16(17)18-19-11-14(20-18)12-7-3-1-4-8-12/h1-11,23H,(H,19,20)(H,21,22)
InChIKeyPBIQPUFDXFEYEP-UHFFFAOYSA-N
XLogP3.84
TPSA77.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol?
The IUPAC name of 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol (CID 135857318) is 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol.
What is the SMILES notation for 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol?
The canonical SMILES for 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol is Oc1c(-c2ccccc2)n[nH]c1-c1ncc(-c2ccccc2)[nH]1.
What is the InChIKey of 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol?
The InChIKey is PBIQPUFDXFEYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O/c23-17-15(13-9-5-2-6-10-13)21-22-16(17)18-19-11-14(20-18)12-7-3-1-4-8-12/h1-11,23H,(H,19,20)(H,21,22).
What are the key properties of 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol?
3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol has a molecular weight of 302.34 g/mol, XLogP of 3.84, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-ol is sourced from PubChem (CID 135857318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).