1-(4-methoxyphenyl)-3-phenylpyrazole

C16H14N2O — CID 14872986

IUPAC1-(4-methoxyphenyl)-3-phenylpyrazole
SMILESCOc1ccc(-n2ccc(-c3ccccc3)n2)cc1
InChIInChI=1S/C16H14N2O/c1-19-15-9-7-14(8-10-15)18-12-11-16(17-18)13-5-3-2-4-6-13/h2-12H,1H3
InChIKeyMZFCTGILLDOBLU-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.55
Rot. Bonds3

About 1-(4-methoxyphenyl)-3-phenylpyrazole

1-(4-methoxyphenyl)-3-phenylpyrazole (PubChem CID 14872986) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-3-phenylpyrazole.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-3-phenylpyrazole
PubChem CID14872986
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name1-(4-methoxyphenyl)-3-phenylpyrazole
SMILESCOc1ccc(-n2ccc(-c3ccccc3)n2)cc1
InChIInChI=1S/C16H14N2O/c1-19-15-9-7-14(8-10-15)18-12-11-16(17-18)13-5-3-2-4-6-13/h2-12H,1H3
InChIKeyMZFCTGILLDOBLU-UHFFFAOYSA-N
XLogP3.55
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-trifluoromethylpyrazole
CID 4306515
[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methanol
CID 882911
[1-benzyl-3-(3-methoxyphenyl)-1H-pyrazol-4-yl]methanol
CID 2496576
({1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl}methyl)methyl[(1-phenyl-1H-pyrazol-4-yl)methyl]amine
CID 26325235
1-(2-methoxyphenyl)-4-((1-phenyl-1H-pyrazol-4-yl)methyl)piperazine
CID 17449900
2-(4-methoxyphenyl)-6-nitro-2H-indazole
CID 622831
3-(4-methoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
CID 6894322
1-[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(3-pyridinylmethyl)methanamine
CID 16189779
(1S)-1-[(4aR,5S)-1-(4-methoxyphenyl)-4a-methyl-5,6,7,8-tetrahydro-4H-benzo[f]indazol-5-yl]ethanol
CID 164621667
3-(3,4-dimethoxyphenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde oxime
CID 6898261
[4-(4-Methoxyphenyl)-1-phenylpyrazol-3-yl]methanol
CID 2512462
N-{1-Ethyl-3-[1-(4-methoxy-phenyl)-5-p-tolyl-1H-pyrazol-3-yl]-prop-2-ynyl}-N-hydroxy-acetamide
CID 9844110

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-3-phenylpyrazole?
The IUPAC name of 1-(4-methoxyphenyl)-3-phenylpyrazole (CID 14872986) is 1-(4-methoxyphenyl)-3-phenylpyrazole.
What is the SMILES notation for 1-(4-methoxyphenyl)-3-phenylpyrazole?
The canonical SMILES for 1-(4-methoxyphenyl)-3-phenylpyrazole is COc1ccc(-n2ccc(-c3ccccc3)n2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-3-phenylpyrazole?
The InChIKey is MZFCTGILLDOBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-19-15-9-7-14(8-10-15)18-12-11-16(17-18)13-5-3-2-4-6-13/h2-12H,1H3.
What are the key properties of 1-(4-methoxyphenyl)-3-phenylpyrazole?
1-(4-methoxyphenyl)-3-phenylpyrazole has a molecular weight of 250.30 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-3-phenylpyrazole is sourced from PubChem (CID 14872986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).