N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine

C10H9F2N3 — CID 82536854

IUPACN-(2,6-difluorophenyl)-1-methylpyrazol-4-amine
SMILESCn1cc(Nc2c(F)cccc2F)cn1
InChIInChI=1S/C10H9F2N3/c1-15-6-7(5-13-15)14-10-8(11)3-2-4-9(10)12/h2-6,14H,1H3
InChIKeyFYPYIEZTPJIRRW-UHFFFAOYSA-N
MW209.20 g/mol
LogP2.44
Rot. Bonds2

About N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine

N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine (PubChem CID 82536854) has the molecular formula C10H9F2N3 and a molecular weight of 209.20 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-1-methylpyrazol-4-amine
PubChem CID82536854
Molecular FormulaC10H9F2N3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC NameN-(2,6-difluorophenyl)-1-methylpyrazol-4-amine
SMILESCn1cc(Nc2c(F)cccc2F)cn1
InChIInChI=1S/C10H9F2N3/c1-15-6-7(5-13-15)14-10-8(11)3-2-4-9(10)12/h2-6,14H,1H3
InChIKeyFYPYIEZTPJIRRW-UHFFFAOYSA-N
XLogP2.44
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,6-difluorophenyl)-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

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine?
The IUPAC name of N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine (CID 82536854) is N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine.
What is the SMILES notation for N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine?
The canonical SMILES for N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine is Cn1cc(Nc2c(F)cccc2F)cn1.
What is the InChIKey of N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine?
The InChIKey is FYPYIEZTPJIRRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3/c1-15-6-7(5-13-15)14-10-8(11)3-2-4-9(10)12/h2-6,14H,1H3.
What are the key properties of N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine?
N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine has a molecular weight of 209.20 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 82536854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).