5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine

C10H9F3N4 — CID 25248264

IUPAC5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine
SMILESCc1cc(N)nn1-c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C10H9F3N4/c1-6-4-8(14)16-17(6)9-3-2-7(5-15-9)10(11,12)13/h2-5H,1H3,(H2,14,16)
InChIKeyTWPCUBGVEVNXBI-UHFFFAOYSA-N
MW242.20 g/mol
LogP2.18
Rot. Bonds1

About 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine

5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine (PubChem CID 25248264) has the molecular formula C10H9F3N4 and a molecular weight of 242.20 g/mol. Its IUPAC name is 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine
PubChem CID25248264
Molecular FormulaC10H9F3N4
Molecular Weight242.20 g/mol
Exact Mass242.08
IUPAC Name5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine
SMILESCc1cc(N)nn1-c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C10H9F3N4/c1-6-4-8(14)16-17(6)9-3-2-7(5-15-9)10(11,12)13/h2-5H,1H3,(H2,14,16)
InChIKeyTWPCUBGVEVNXBI-UHFFFAOYSA-N
XLogP2.18
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine?
The IUPAC name of 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine (CID 25248264) is 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine.
What is the SMILES notation for 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine?
The canonical SMILES for 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine is Cc1cc(N)nn1-c1ccc(C(F)(F)F)cn1.
What is the InChIKey of 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine?
The InChIKey is TWPCUBGVEVNXBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N4/c1-6-4-8(14)16-17(6)9-3-2-7(5-15-9)10(11,12)13/h2-5H,1H3,(H2,14,16).
What are the key properties of 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine?
5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine has a molecular weight of 242.20 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazol-3-amine is sourced from PubChem (CID 25248264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).