4-(4-methoxyphenyl)-1-methylpyrazole

C11H12N2O — CID 4101323

IUPAC4-(4-methoxyphenyl)-1-methylpyrazole
SMILESCOc1ccc(-c2cnn(C)c2)cc1
InChIInChI=1S/C11H12N2O/c1-13-8-10(7-12-13)9-3-5-11(14-2)6-4-9/h3-8H,1-2H3
InChIKeyIZWSPAWAXBPBDU-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.10
Rot. Bonds2

About 4-(4-methoxyphenyl)-1-methylpyrazole

4-(4-methoxyphenyl)-1-methylpyrazole (PubChem CID 4101323) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-1-methylpyrazole.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-1-methylpyrazole
PubChem CID4101323
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name4-(4-methoxyphenyl)-1-methylpyrazole
SMILESCOc1ccc(-c2cnn(C)c2)cc1
InChIInChI=1S/C11H12N2O/c1-13-8-10(7-12-13)9-3-5-11(14-2)6-4-9/h3-8H,1-2H3
InChIKeyIZWSPAWAXBPBDU-UHFFFAOYSA-N
XLogP2.10
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 ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-(4-phenylphenyl)pyrazole
CID 135064285
3-[(4-methoxyphenyl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrimidine
CID 11978219
1-(3-chloropropyl)-4-(4-methoxyphenyl)pyrazole
CID 22715717
3-[4-(4-methoxyphenyl)pyrazol-1-yl]propanenitrile
CID 82115258
1-(2-methoxyethyl)-4-[4-(4-methoxyphenoxy)phenyl]pyrazole
CID 166333732
2-methoxy-5-(1-methylpyrazol-4-yl)benzenethiol
CID 174151969
4-(3-ethyl-5-methoxyphenyl)-1-methylpyrazole
CID 170591109
4-[4-(1-methylpyrazol-4-yl)phenoxy]butane-1,2-diol
CID 174593935
4-[4-(4-methoxyphenyl)pyrazol-1-yl]butanoic acid
CID 139033660
[4-(1-methylpyrazol-4-yl)phenyl]thiourea
CID 169356710
5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]-1,2-oxazole
CID 155277374
N-methyl-1-[4-(1-methylpyrazol-4-yl)phenyl]methanamine
CID 61033287

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-1-methylpyrazole?
The IUPAC name of 4-(4-methoxyphenyl)-1-methylpyrazole (CID 4101323) is 4-(4-methoxyphenyl)-1-methylpyrazole.
What is the SMILES notation for 4-(4-methoxyphenyl)-1-methylpyrazole?
The canonical SMILES for 4-(4-methoxyphenyl)-1-methylpyrazole is COc1ccc(-c2cnn(C)c2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-1-methylpyrazole?
The InChIKey is IZWSPAWAXBPBDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-13-8-10(7-12-13)9-3-5-11(14-2)6-4-9/h3-8H,1-2H3.
What are the key properties of 4-(4-methoxyphenyl)-1-methylpyrazole?
4-(4-methoxyphenyl)-1-methylpyrazole has a molecular weight of 188.23 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-1-methylpyrazole is sourced from PubChem (CID 4101323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).