4-methoxy-1-(4-methylphenyl)pyrazole

C11H12N2O — CID 117229729

IUPAC4-methoxy-1-(4-methylphenyl)pyrazole
SMILESCOc1cnn(-c2ccc(C)cc2)c1
InChIInChI=1S/C11H12N2O/c1-9-3-5-10(6-4-9)13-8-11(14-2)7-12-13/h3-8H,1-2H3
InChIKeyAQXADSARMQEGGH-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.19
Rot. Bonds2

About 4-methoxy-1-(4-methylphenyl)pyrazole

4-methoxy-1-(4-methylphenyl)pyrazole (PubChem CID 117229729) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 4-methoxy-1-(4-methylphenyl)pyrazole.

Molecular Properties

Compound Name4-methoxy-1-(4-methylphenyl)pyrazole
PubChem CID117229729
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name4-methoxy-1-(4-methylphenyl)pyrazole
SMILESCOc1cnn(-c2ccc(C)cc2)c1
InChIInChI=1S/C11H12N2O/c1-9-3-5-10(6-4-9)13-8-11(14-2)7-12-13/h3-8H,1-2H3
InChIKeyAQXADSARMQEGGH-UHFFFAOYSA-N
XLogP2.19
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-methoxypyrazol-1-yl)phenol
CID 88996321
1-(4-fluorophenyl)-4-methoxypyrazole
CID 117229730
4-(methoxymethoxy)-1-(4-methylphenyl)pyrazole
CID 177250502
ethane;4-ethoxy-1-(4-methylphenyl)pyrazole
CID 145188888
1-[1-(4-methylphenyl)pyrazol-4-yl]oxyethanamine
CID 117230498
1-(4-chlorophenyl)-4-(4-methylphenoxy)pyrazole
CID 117229529
1,4-bis(4-methylphenyl)pyrazole;methanamine
CID 153378123
1-(4-ethoxyphenyl)-4-(4-methylphenyl)pyrazole
CID 107958448
4-(3-chlorophenoxy)-1-(4-methoxyphenyl)pyrazole
CID 117229414
1-(4-fluorophenyl)-4-(2-methoxyphenoxy)pyrazole
CID 117229286
4-(4-methoxyphenyl)-1-(4-methylphenyl)triazole
CID 141476610
4-(4-methoxyphenyl)-1-[4-(trifluoromethoxy)phenyl]pyrazole
CID 3676782

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(4-methylphenyl)pyrazole?
The IUPAC name of 4-methoxy-1-(4-methylphenyl)pyrazole (CID 117229729) is 4-methoxy-1-(4-methylphenyl)pyrazole.
What is the SMILES notation for 4-methoxy-1-(4-methylphenyl)pyrazole?
The canonical SMILES for 4-methoxy-1-(4-methylphenyl)pyrazole is COc1cnn(-c2ccc(C)cc2)c1.
What is the InChIKey of 4-methoxy-1-(4-methylphenyl)pyrazole?
The InChIKey is AQXADSARMQEGGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-9-3-5-10(6-4-9)13-8-11(14-2)7-12-13/h3-8H,1-2H3.
What are the key properties of 4-methoxy-1-(4-methylphenyl)pyrazole?
4-methoxy-1-(4-methylphenyl)pyrazole has a molecular weight of 188.23 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(4-methylphenyl)pyrazole is sourced from PubChem (CID 117229729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).