5-(2-phenoxyphenyl)-1H-pyrazole

C15H12N2O — CID 90896725

IUPAC5-(2-phenoxyphenyl)-1H-pyrazole
SMILESc1ccc(Oc2ccccc2-c2ccn[nH]2)cc1
InChIInChI=1S/C15H12N2O/c1-2-6-12(7-3-1)18-15-9-5-4-8-13(15)14-10-11-16-17-14/h1-11H,(H,16,17)
InChIKeyBPOVHOUGLSJMCI-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.87
Rot. Bonds3

About 5-(2-phenoxyphenyl)-1H-pyrazole

5-(2-phenoxyphenyl)-1H-pyrazole (PubChem CID 90896725) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 5-(2-phenoxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(2-phenoxyphenyl)-1H-pyrazole
PubChem CID90896725
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name5-(2-phenoxyphenyl)-1H-pyrazole
SMILESc1ccc(Oc2ccccc2-c2ccn[nH]2)cc1
InChIInChI=1S/C15H12N2O/c1-2-6-12(7-3-1)18-15-9-5-4-8-13(15)14-10-11-16-17-14/h1-11H,(H,16,17)
InChIKeyBPOVHOUGLSJMCI-UHFFFAOYSA-N
XLogP3.87
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

o-(1H-pyrazol-3-yl)phenol
CID 819511
3,5-bis(4-methoxyphenyl)-1H-pyrazole
CID 658538
5-(4-phenoxyphenyl)-1H-pyrazole
CID 2806138
4-Fluoro-2-(1H-pyrazol-3-yl)phenol
CID 5068606
3-(2-methoxyphenyl)-1H-pyrazol-5-amine
CID 3240675
3-(4-(4-Fluorophenoxy)phenyl)-1H-pyrazole
CID 9816478
4-(4-methoxyphenyl)-3-methyl-1H-pyrazole
CID 2805464
5-[4-(4-methoxyphenoxy)phenyl]-1H-pyrazole
CID 2806185
2-[5-(4-Methoxy-phenyl)-1H-pyrazol-3-yl]-phenol
CID 3750129
4-Methoxy-1H-indazole
CID 24729333
3-(4-Methoxyphenyl)-1H-Pyrazole
CID 599984
3-(3-Methoxyphenyl)-1H-Pyrazole
CID 2736766

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenoxyphenyl)-1H-pyrazole?
The IUPAC name of 5-(2-phenoxyphenyl)-1H-pyrazole (CID 90896725) is 5-(2-phenoxyphenyl)-1H-pyrazole.
What is the SMILES notation for 5-(2-phenoxyphenyl)-1H-pyrazole?
The canonical SMILES for 5-(2-phenoxyphenyl)-1H-pyrazole is c1ccc(Oc2ccccc2-c2ccn[nH]2)cc1.
What is the InChIKey of 5-(2-phenoxyphenyl)-1H-pyrazole?
The InChIKey is BPOVHOUGLSJMCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-2-6-12(7-3-1)18-15-9-5-4-8-13(15)14-10-11-16-17-14/h1-11H,(H,16,17).
What are the key properties of 5-(2-phenoxyphenyl)-1H-pyrazole?
5-(2-phenoxyphenyl)-1H-pyrazole has a molecular weight of 236.27 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenoxyphenyl)-1H-pyrazole is sourced from PubChem (CID 90896725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).