4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine

C11H11F2N3O — CID 117350174

IUPAC4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine
SMILESCOc1cc(F)cc(F)c1-c1cnn(C)c1N
InChIInChI=1S/C11H11F2N3O/c1-16-11(14)7(5-15-16)10-8(13)3-6(12)4-9(10)17-2/h3-5H,14H2,1-2H3
InChIKeyXSTKEBKUZOEHRK-UHFFFAOYSA-N
MW239.23 g/mol
LogP1.96
Rot. Bonds2

About 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine

4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine (PubChem CID 117350174) has the molecular formula C11H11F2N3O and a molecular weight of 239.23 g/mol. Its IUPAC name is 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine
PubChem CID117350174
Molecular FormulaC11H11F2N3O
Molecular Weight239.23 g/mol
Exact Mass239.09
IUPAC Name4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine
SMILESCOc1cc(F)cc(F)c1-c1cnn(C)c1N
InChIInChI=1S/C11H11F2N3O/c1-16-11(14)7(5-15-16)10-8(13)3-6(12)4-9(10)17-2/h3-5H,14H2,1-2H3
InChIKeyXSTKEBKUZOEHRK-UHFFFAOYSA-N
XLogP1.96
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4,6-difluoro-2,3-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117426013
4-(5-amino-1-methylpyrazol-4-yl)-3-methoxy-5-methylphenol
CID 117338197
4-(3,5-difluoro-2-methylphenyl)-1-methylpyrazol-5-amine
CID 117319251
4-(2,4-difluoro-3,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117426009
4-(3-fluoro-5-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117315496
2-(5-amino-1-methylpyrazol-4-yl)-4,6-difluoro-3-methoxyphenol
CID 117390500
4-(3-fluoro-2-methoxy-6-methylphenyl)-1-methylpyrazol-5-amine
CID 117342062
4-(3-chloro-5-fluoro-2-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117392093
4-(2,3-dimethoxy-5,6-dimethylphenyl)-1-methylpyrazol-5-amine
CID 117407767
4-(5-bromo-3-fluoro-2-methoxy-6-methylphenyl)-1-methylpyrazol-5-amine
CID 117499160
4-(3-fluoro-5-methoxy-4-propan-2-ylphenyl)-1-methylpyrazol-5-amine
CID 117412665
4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
CID 117370777

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine (CID 117350174) is 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine is COc1cc(F)cc(F)c1-c1cnn(C)c1N.
What is the InChIKey of 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine?
The InChIKey is XSTKEBKUZOEHRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N3O/c1-16-11(14)7(5-15-16)10-8(13)3-6(12)4-9(10)17-2/h3-5H,14H2,1-2H3.
What are the key properties of 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine?
4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine has a molecular weight of 239.23 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-difluoro-6-methoxyphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117350174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).