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

C8H6F3N3 — CID 817912

IUPAC7-(trifluoromethyl)-1H-indazol-3-amine
SMILESNc1n[nH]c2c(C(F)(F)F)cccc12
InChIInChI=1S/C8H6F3N3/c9-8(10,11)5-3-1-2-4-6(5)13-14-7(4)12/h1-3H,(H3,12,13,14)
InChIKeyRLNKCXFTRPDGAP-UHFFFAOYSA-N
MW201.15 g/mol
LogP2.16
Rot. Bonds

About 7-(trifluoromethyl)-1H-indazol-3-amine

7-(trifluoromethyl)-1H-indazol-3-amine (PubChem CID 817912) has the molecular formula C8H6F3N3 and a molecular weight of 201.15 g/mol. Its IUPAC name is 7-(trifluoromethyl)-1H-indazol-3-amine.

Molecular Properties

Compound Name7-(trifluoromethyl)-1H-indazol-3-amine
PubChem CID817912
Molecular FormulaC8H6F3N3
Molecular Weight201.15 g/mol
Exact Mass201.05
IUPAC Name7-(trifluoromethyl)-1H-indazol-3-amine
SMILESNc1n[nH]c2c(C(F)(F)F)cccc12
InChIInChI=1S/C8H6F3N3/c9-8(10,11)5-3-1-2-4-6(5)13-14-7(4)12/h1-3H,(H3,12,13,14)
InChIKeyRLNKCXFTRPDGAP-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 7-(trifluoromethyl)-1H-indazol-3-amine?
The IUPAC name of 7-(trifluoromethyl)-1H-indazol-3-amine (CID 817912) is 7-(trifluoromethyl)-1H-indazol-3-amine.
What is the SMILES notation for 7-(trifluoromethyl)-1H-indazol-3-amine?
The canonical SMILES for 7-(trifluoromethyl)-1H-indazol-3-amine is Nc1n[nH]c2c(C(F)(F)F)cccc12.
What is the InChIKey of 7-(trifluoromethyl)-1H-indazol-3-amine?
The InChIKey is RLNKCXFTRPDGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3N3/c9-8(10,11)5-3-1-2-4-6(5)13-14-7(4)12/h1-3H,(H3,12,13,14).
What are the key properties of 7-(trifluoromethyl)-1H-indazol-3-amine?
7-(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 7-(trifluoromethyl)-1H-indazol-3-amine is sourced from PubChem (CID 817912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).