4-(trifluoromethyl)pyrazol-1-amine

C4H4F3N3 — CID 66968628

IUPAC4-(trifluoromethyl)pyrazol-1-amine
SMILESNn1cc(C(F)(F)F)cn1
InChIInChI=1S/C4H4F3N3/c5-4(6,7)3-1-9-10(8)2-3/h1-2H,8H2
InChIKeyFZGADESLAXNRDF-UHFFFAOYSA-N
MW151.09 g/mol
LogP0.62
Rot. Bonds

About 4-(trifluoromethyl)pyrazol-1-amine

4-(trifluoromethyl)pyrazol-1-amine (PubChem CID 66968628) has the molecular formula C4H4F3N3 and a molecular weight of 151.09 g/mol. Its IUPAC name is 4-(trifluoromethyl)pyrazol-1-amine.

Molecular Properties

Compound Name4-(trifluoromethyl)pyrazol-1-amine
PubChem CID66968628
Molecular FormulaC4H4F3N3
Molecular Weight151.09 g/mol
Exact Mass151.04
IUPAC Name4-(trifluoromethyl)pyrazol-1-amine
SMILESNn1cc(C(F)(F)F)cn1
InChIInChI=1S/C4H4F3N3/c5-4(6,7)3-1-9-10(8)2-3/h1-2H,8H2
InChIKeyFZGADESLAXNRDF-UHFFFAOYSA-N
XLogP0.62
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.09
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methylpyrazole
CID 3406
1H-pyrazol-4-ylmethanamine
CID 23005583
4-(Trifluoromethyl)-1H-pyrazole
CID 12777795
4-(difluoromethyl)-1H-pyrazole
CID 67635188
4-(2,2,2-trifluoroethyl)-1H-pyrazole
CID 91351724
4-(Trifluoromethyl)-5-(tributylstannyl)pyrazole
CID 11316234
4-Methyl-1H-pyrazol-1-amine
CID 13483629
Amino-1h-pyrazole-4-carbonitrile
CID 20141959
4-(azidomethyl)-1H-pyrazole
CID 121212022
Potassium 4-(trifluoromethyl)pyrazol-1-ide
CID 58711209
4-(fluoromethyl)-1H-pyrazole
CID 67635481
5-fluoro-4-methyl-1H-pyrazole
CID 89995420

Frequently Asked Questions

What is the IUPAC name of 4-(trifluoromethyl)pyrazol-1-amine?
The IUPAC name of 4-(trifluoromethyl)pyrazol-1-amine (CID 66968628) is 4-(trifluoromethyl)pyrazol-1-amine.
What is the SMILES notation for 4-(trifluoromethyl)pyrazol-1-amine?
The canonical SMILES for 4-(trifluoromethyl)pyrazol-1-amine is Nn1cc(C(F)(F)F)cn1.
What is the InChIKey of 4-(trifluoromethyl)pyrazol-1-amine?
The InChIKey is FZGADESLAXNRDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F3N3/c5-4(6,7)3-1-9-10(8)2-3/h1-2H,8H2.
What are the key properties of 4-(trifluoromethyl)pyrazol-1-amine?
4-(trifluoromethyl)pyrazol-1-amine has a molecular weight of 151.09 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(trifluoromethyl)pyrazol-1-amine is sourced from PubChem (CID 66968628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).