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

C5H6F3N3 — CID 11480632

IUPAC4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESCc1c(N)n[nH]c1C(F)(F)F
InChIInChI=1S/C5H6F3N3/c1-2-3(5(6,7)8)10-11-4(2)9/h1H3,(H3,9,10,11)
InChIKeyYTARZCOGKBEMSD-UHFFFAOYSA-N
MW165.12 g/mol
LogP1.32
Rot. Bonds

About 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine

4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine (PubChem CID 11480632) has the molecular formula C5H6F3N3 and a molecular weight of 165.12 g/mol. Its IUPAC name is 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
PubChem CID11480632
Molecular FormulaC5H6F3N3
Molecular Weight165.12 g/mol
Exact Mass165.05
IUPAC Name4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine
SMILESCc1c(N)n[nH]c1C(F)(F)F
InChIInChI=1S/C5H6F3N3/c1-2-3(5(6,7)8)10-11-4(2)9/h1H3,(H3,9,10,11)
InChIKeyYTARZCOGKBEMSD-UHFFFAOYSA-N
XLogP1.32
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.12
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-5-methyl-1H-pyrazole-4-carbonitrile
CID 227460
4-ethyl-3-methyl-1H-pyrazol-5-amine
CID 3159689
3-(trifluoromethyl)-1H-pyrazol-5-amine
CID 19623305
4,5-Dimethyl-1H-pyrazol-3-ylamine hydrochloride
CID 51071980
5-Amino-3-(trifluoromethyl)-1H-pyrazole-4-carbonitrile
CID 85519445
4-ethyl-3-(trifluoromethyl)-1H-pyrazol-5-amine
CID 33782881
3-(difluoromethyl)-4-methyl-5-nitro-1H-pyrazole
CID 176437671
4,5-dimethyl-1H-pyrazol-3-amine
CID 4737029
4-Iodo-5-(trifluoromethyl)-1H-pyrazol-3-amine
CID 91666192
4-(Propan-2-yl)-3-(trifluoromethyl)-1h-pyrazol-5-amine
CID 116227846
4-Fluoro-3-methyl-1H-pyrazol-5-amine
CID 118886597
3-fluoro-5-methyl-4-(trifluoromethyl)-1H-pyrazole
CID 130330494

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The IUPAC name of 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine (CID 11480632) is 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The canonical SMILES for 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine is Cc1c(N)n[nH]c1C(F)(F)F.
What is the InChIKey of 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
The InChIKey is YTARZCOGKBEMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F3N3/c1-2-3(5(6,7)8)10-11-4(2)9/h1H3,(H3,9,10,11).
What are the key properties of 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine?
4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine has a molecular weight of 165.12 g/mol, XLogP of 1.32, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(trifluoromethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 11480632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).