6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine

C9H7F3N4 — CID 177367973

IUPAC6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine
SMILESNc1ccc(C(F)(F)F)c(-c2cn[nH]c2)n1
InChIInChI=1S/C9H7F3N4/c10-9(11,12)6-1-2-7(13)16-8(6)5-3-14-15-4-5/h1-4H,(H2,13,16)(H,14,15)
InChIKeyVZAOVSLNEHJLOZ-UHFFFAOYSA-N
MW228.18 g/mol
LogP2.07
Rot. Bonds1

About 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine

6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 177367973) has the molecular formula C9H7F3N4 and a molecular weight of 228.18 g/mol. Its IUPAC name is 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine
PubChem CID177367973
Molecular FormulaC9H7F3N4
Molecular Weight228.18 g/mol
Exact Mass228.06
IUPAC Name6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine
SMILESNc1ccc(C(F)(F)F)c(-c2cn[nH]c2)n1
InChIInChI=1S/C9H7F3N4/c10-9(11,12)6-1-2-7(13)16-8(6)5-3-14-15-4-5/h1-4H,(H2,13,16)(H,14,15)
InChIKeyVZAOVSLNEHJLOZ-UHFFFAOYSA-N
XLogP2.07
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.18
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine (CID 177367973) is 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine is Nc1ccc(C(F)(F)F)c(-c2cn[nH]c2)n1.
What is the InChIKey of 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is VZAOVSLNEHJLOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F3N4/c10-9(11,12)6-1-2-7(13)16-8(6)5-3-14-15-4-5/h1-4H,(H2,13,16)(H,14,15).
What are the key properties of 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine?
6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 228.18 g/mol, XLogP of 2.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 177367973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).