N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine

C5H6F3N3 — CID 54351446

IUPACN-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESCNc1cc(C(F)(F)F)[nH]n1
InChIInChI=1S/C5H6F3N3/c1-9-4-2-3(10-11-4)5(6,7)8/h2H,1H3,(H2,9,10,11)
InChIKeyUGBLXUVMPXXKRK-UHFFFAOYSA-N
MW165.12 g/mol
LogP1.47
Rot. Bonds1

About N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine

N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine (PubChem CID 54351446) has the molecular formula C5H6F3N3 and a molecular weight of 165.12 g/mol. Its IUPAC name is N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound NameN-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
PubChem CID54351446
Molecular FormulaC5H6F3N3
Molecular Weight165.12 g/mol
Exact Mass165.05
IUPAC NameN-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESCNc1cc(C(F)(F)F)[nH]n1
InChIInChI=1S/C5H6F3N3/c1-9-4-2-3(10-11-4)5(6,7)8/h2H,1H3,(H2,9,10,11)
InChIKeyUGBLXUVMPXXKRK-UHFFFAOYSA-N
XLogP1.47
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.12
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-5-(trifluoromethyl)-1H-pyrazol-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 N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The IUPAC name of N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine (CID 54351446) is N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The canonical SMILES for N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine is CNc1cc(C(F)(F)F)[nH]n1.
What is the InChIKey of N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The InChIKey is UGBLXUVMPXXKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F3N3/c1-9-4-2-3(10-11-4)5(6,7)8/h2H,1H3,(H2,9,10,11).
What are the key properties of N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine has a molecular weight of 165.12 g/mol, XLogP of 1.47, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 54351446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).