5-(difluoromethoxy)-1-methylpyrazol-3-amine

C5H7F2N3O — CID 15767487

IUPAC5-(difluoromethoxy)-1-methylpyrazol-3-amine
SMILESCn1nc(N)cc1OC(F)F
InChIInChI=1S/C5H7F2N3O/c1-10-4(11-5(6)7)2-3(8)9-10/h2,5H,1H3,(H2,8,9)
InChIKeySVUHJVPUSLBKPZ-UHFFFAOYSA-N
MW163.13 g/mol
LogP0.60
Rot. Bonds2

About 5-(difluoromethoxy)-1-methylpyrazol-3-amine

5-(difluoromethoxy)-1-methylpyrazol-3-amine (PubChem CID 15767487) has the molecular formula C5H7F2N3O and a molecular weight of 163.13 g/mol. Its IUPAC name is 5-(difluoromethoxy)-1-methylpyrazol-3-amine.

Molecular Properties

Compound Name5-(difluoromethoxy)-1-methylpyrazol-3-amine
PubChem CID15767487
Molecular FormulaC5H7F2N3O
Molecular Weight163.13 g/mol
Exact Mass163.06
IUPAC Name5-(difluoromethoxy)-1-methylpyrazol-3-amine
SMILESCn1nc(N)cc1OC(F)F
InChIInChI=1S/C5H7F2N3O/c1-10-4(11-5(6)7)2-3(8)9-10/h2,5H,1H3,(H2,8,9)
InChIKeySVUHJVPUSLBKPZ-UHFFFAOYSA-N
XLogP0.60
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.13
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(difluoromethoxy)-1-methylpyrazol-3-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 5-(difluoromethoxy)-1-methylpyrazol-3-amine?
The IUPAC name of 5-(difluoromethoxy)-1-methylpyrazol-3-amine (CID 15767487) is 5-(difluoromethoxy)-1-methylpyrazol-3-amine.
What is the SMILES notation for 5-(difluoromethoxy)-1-methylpyrazol-3-amine?
The canonical SMILES for 5-(difluoromethoxy)-1-methylpyrazol-3-amine is Cn1nc(N)cc1OC(F)F.
What is the InChIKey of 5-(difluoromethoxy)-1-methylpyrazol-3-amine?
The InChIKey is SVUHJVPUSLBKPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F2N3O/c1-10-4(11-5(6)7)2-3(8)9-10/h2,5H,1H3,(H2,8,9).
What are the key properties of 5-(difluoromethoxy)-1-methylpyrazol-3-amine?
5-(difluoromethoxy)-1-methylpyrazol-3-amine has a molecular weight of 163.13 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-1-methylpyrazol-3-amine is sourced from PubChem (CID 15767487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).