3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine

C10H9F2N3O — CID 86207893

IUPAC3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine
SMILESCn1cc(N)c(Oc2ccc(F)cc2F)n1
InChIInChI=1S/C10H9F2N3O/c1-15-5-8(13)10(14-15)16-9-3-2-6(11)4-7(9)12/h2-5H,13H2,1H3
InChIKeyYQOKNMSSSAPZFT-UHFFFAOYSA-N
MW225.20 g/mol
LogP2.07
Rot. Bonds2

About 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine

3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine (PubChem CID 86207893) has the molecular formula C10H9F2N3O and a molecular weight of 225.20 g/mol. Its IUPAC name is 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine
PubChem CID86207893
Molecular FormulaC10H9F2N3O
Molecular Weight225.20 g/mol
Exact Mass225.07
IUPAC Name3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine
SMILESCn1cc(N)c(Oc2ccc(F)cc2F)n1
InChIInChI=1S/C10H9F2N3O/c1-15-5-8(13)10(14-15)16-9-3-2-6(11)4-7(9)12/h2-5H,13H2,1H3
InChIKeyYQOKNMSSSAPZFT-UHFFFAOYSA-N
XLogP2.07
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.20
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-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-((1-methyl-1H-pyrazol-4-yl)oxy)aniline
CID 69194299
N-[2-(4-fluorophenoxy)ethyl]-2-pyrazol-1-ylethanamine
CID 53626005
3-phenoxy-N-(2-pyrazol-1-ylethyl)propan-1-amine
CID 53626025
2-(4-fluorophenoxy)-N-(1-methylpyrazol-4-yl)ethanesulfonamide
CID 60343625
2-(2-fluorophenoxy)-N-(1-(tetrahydrofuran-3-yl)-1H-pyrazol-4-yl)acetamide
CID 71810096
N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-2-(4-fluorophenoxy)ethanesulfonamide
CID 71998842
1-[1-[3-(4-Fluorophenoxy)propyl]azetidin-3-yl]pyrazole
CID 72140862
N-[2-(4-fluorophenoxy)ethyl]-1-methylpyrazol-4-amine
CID 75450237
3-fluoro-4-((1-methyl-1H-pyrazol-4-yl)methoxy)aniline
CID 19627211
5-(3-fluorophenoxy)-1,3-dimethyl-1H-pyrazol-4-amine dihydrochloride
CID 165669403
N-(1-methyl-3-phenoxypyrazol-4-yl)-3-sulfanylpropanamide
CID 177680897
1-[(4-ethylphenoxy)methyl]-1H-pyrazol-4-amine
CID 7017257

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine?
The IUPAC name of 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine (CID 86207893) is 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine.
What is the SMILES notation for 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine?
The canonical SMILES for 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine is Cn1cc(N)c(Oc2ccc(F)cc2F)n1.
What is the InChIKey of 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine?
The InChIKey is YQOKNMSSSAPZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3O/c1-15-5-8(13)10(14-15)16-9-3-2-6(11)4-7(9)12/h2-5H,13H2,1H3.
What are the key properties of 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine?
3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine has a molecular weight of 225.20 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-difluorophenoxy)-1-methylpyrazol-4-amine is sourced from PubChem (CID 86207893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).