5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole

C19H20N2O2 — CID 155516004

IUPAC5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole
SMILESCOc1ccccc1-c1cc(-c2ccc(OC(C)C)cc2)n[nH]1
InChIInChI=1S/C19H20N2O2/c1-13(2)23-15-10-8-14(9-11-15)17-12-18(21-20-17)16-6-4-5-7-19(16)22-3/h4-13H,1-3H3,(H,20,21)
InChIKeyOLXAYPABYZRBLL-UHFFFAOYSA-N
MW308.38 g/mol
LogP4.54
Rot. Bonds5

About 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole

5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole (PubChem CID 155516004) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole
PubChem CID155516004
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole
SMILESCOc1ccccc1-c1cc(-c2ccc(OC(C)C)cc2)n[nH]1
InChIInChI=1S/C19H20N2O2/c1-13(2)23-15-10-8-14(9-11-15)17-12-18(21-20-17)16-6-4-5-7-19(16)22-3/h4-13H,1-3H3,(H,20,21)
InChIKeyOLXAYPABYZRBLL-UHFFFAOYSA-N
XLogP4.54
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[5-(2-propan-2-yloxyphenyl)-1H-pyrazol-3-yl]aniline
CID 54853323
5-methyl-3-(4-propan-2-yloxyphenyl)-1H-pyrazole
CID 116856590
2-[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]phenol
CID 136622086
4-methoxy-3-(3-phenyl-1H-pyrazol-5-yl)aniline
CID 58195321
3-(4-methoxyphenyl)-5-(2-nitrophenyl)-1H-pyrazole
CID 71743082
5-(2-methoxyphenyl)-2-propan-2-yloxyaniline
CID 164512499
3-(2,3-dimethoxyphenyl)-5-[3-(4-propan-2-ylphenyl)-1H-pyrazol-5-yl]-1,2,4-oxadiazole
CID 53022147
6-oxo-3-(4-propan-2-yloxyphenyl)-1H-pyridazine-5-carboxylic acid
CID 82446124
3-(4-methoxyphenyl)-5-thiophen-2-yl-1H-pyrazole
CID 18175413
2-(2-methoxyphenyl)-2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]ethanamine
CID 83986936
1,7-difluoro-6-methoxy-3-(4-propan-2-yloxyphenyl)isoquinoline
CID 70979158
4,5-dimethyl-2-(3-phenyl-1H-pyrazol-5-yl)phenol
CID 135465890

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole?
The IUPAC name of 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole (CID 155516004) is 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole.
What is the SMILES notation for 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole?
The canonical SMILES for 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole is COc1ccccc1-c1cc(-c2ccc(OC(C)C)cc2)n[nH]1.
What is the InChIKey of 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole?
The InChIKey is OLXAYPABYZRBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-13(2)23-15-10-8-14(9-11-15)17-12-18(21-20-17)16-6-4-5-7-19(16)22-3/h4-13H,1-3H3,(H,20,21).
What are the key properties of 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole?
5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole has a molecular weight of 308.38 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)-1H-pyrazole is sourced from PubChem (CID 155516004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).