5-(trifluoromethyl)-1H-indazol-3-amine

C8H6F3N3 — CID 16736

IUPAC5-(trifluoromethyl)-1H-indazol-3-amine
SMILESNc1n[nH]c2ccc(C(F)(F)F)cc12
InChIInChI=1S/C8H6F3N3/c9-8(10,11)4-1-2-6-5(3-4)7(12)14-13-6/h1-3H,(H3,12,13,14)
InChIKeyZXZTZRVCWTWKCH-UHFFFAOYSA-N
MW201.15 g/mol
LogP2.16
Rot. Bonds

About 5-(trifluoromethyl)-1H-indazol-3-amine

5-(trifluoromethyl)-1H-indazol-3-amine (PubChem CID 16736) has the molecular formula C8H6F3N3 and a molecular weight of 201.15 g/mol. Its IUPAC name is 5-(trifluoromethyl)-1H-indazol-3-amine.

Molecular Properties

Compound Name5-(trifluoromethyl)-1H-indazol-3-amine
PubChem CID16736
Molecular FormulaC8H6F3N3
Molecular Weight201.15 g/mol
Exact Mass201.05
IUPAC Name5-(trifluoromethyl)-1H-indazol-3-amine
SMILESNc1n[nH]c2ccc(C(F)(F)F)cc12
InChIInChI=1S/C8H6F3N3/c9-8(10,11)4-1-2-6-5(3-4)7(12)14-13-6/h1-3H,(H3,12,13,14)
InChIKeyZXZTZRVCWTWKCH-UHFFFAOYSA-N
XLogP2.16
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.15
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(trifluoromethyl)-1H-indazol-3-amine?
The IUPAC name of 5-(trifluoromethyl)-1H-indazol-3-amine (CID 16736) is 5-(trifluoromethyl)-1H-indazol-3-amine.
What is the SMILES notation for 5-(trifluoromethyl)-1H-indazol-3-amine?
The canonical SMILES for 5-(trifluoromethyl)-1H-indazol-3-amine is Nc1n[nH]c2ccc(C(F)(F)F)cc12.
What is the InChIKey of 5-(trifluoromethyl)-1H-indazol-3-amine?
The InChIKey is ZXZTZRVCWTWKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3N3/c9-8(10,11)4-1-2-6-5(3-4)7(12)14-13-6/h1-3H,(H3,12,13,14).
What are the key properties of 5-(trifluoromethyl)-1H-indazol-3-amine?
5-(trifluoromethyl)-1H-indazol-3-amine has a molecular weight of 201.15 g/mol, XLogP of 2.16, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(trifluoromethyl)-1H-indazol-3-amine is sourced from PubChem (CID 16736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).