3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole

C18H18N2O2 — CID 173202359

IUPAC3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole
SMILESCOc1ccc(-n2nc(OC)cc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C18H18N2O2/c1-13-4-6-14(7-5-13)17-12-18(22-3)19-20(17)15-8-10-16(21-2)11-9-15/h4-12H,1-3H3
InChIKeyNYCVTCKEGFTBTK-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.86
Rot. Bonds4

About 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole

3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole (PubChem CID 173202359) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole.

Molecular Properties

Compound Name3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole
PubChem CID173202359
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole
SMILESCOc1ccc(-n2nc(OC)cc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C18H18N2O2/c1-13-4-6-14(7-5-13)17-12-18(22-3)19-20(17)15-8-10-16(21-2)11-9-15/h4-12H,1-3H3
InChIKeyNYCVTCKEGFTBTK-UHFFFAOYSA-N
XLogP3.86
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-3-methoxy-5-(4-methylphenyl)pyrazole
CID 174579266
[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl] acetate
CID 150185883
2-[4-[3-methoxy-1-(4-methoxyphenyl)pyrazol-5-yl]phenoxy]acetic acid
CID 58806820
[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]methanamine
CID 82072095
N-[4-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]but-3-yn-2-yl]hydroxylamine
CID 15461756
4-[1-(4-methoxyphenyl)-3-propan-2-yloxypyrazol-5-yl]benzonitrile
CID 21090930
methanesulfonamide;5-(4-methoxyphenyl)-1-(4-methylphenyl)-3-(trifluoromethyl)pyrazole
CID 142958737
3-methyl-1,5-bis(4-methylphenyl)pyrazole
CID 59881727
3-[1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazol-3-yl]-2-(4-methylphenyl)propanal
CID 142851613
2-(4-methoxyphenyl)-5-[5-(4-methylphenyl)-1-phenylpyrazol-3-yl]-1,3,4-oxadiazole
CID 1497065
3-methoxy-1-(4-methylphenyl)pyrazole-5-carboxylic acid
CID 83864128
ethyl 2-[5-(4-methoxyphenyl)-1-(4-propan-2-ylphenyl)pyrazol-3-yl]oxyacetate
CID 46901523

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole?
The IUPAC name of 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole (CID 173202359) is 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole.
What is the SMILES notation for 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole?
The canonical SMILES for 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole is COc1ccc(-n2nc(OC)cc2-c2ccc(C)cc2)cc1.
What is the InChIKey of 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole?
The InChIKey is NYCVTCKEGFTBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-13-4-6-14(7-5-13)17-12-18(22-3)19-20(17)15-8-10-16(21-2)11-9-15/h4-12H,1-3H3.
What are the key properties of 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole?
3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole has a molecular weight of 294.35 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-(4-methoxyphenyl)-5-(4-methylphenyl)pyrazole is sourced from PubChem (CID 173202359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).