2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine

C10H10F3N3 — CID 76846281

IUPAC2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine
SMILESNCCc1[nH]nc2cc(C(F)(F)F)ccc12
InChIInChI=1S/C10H10F3N3/c11-10(12,13)6-1-2-7-8(3-4-14)15-16-9(7)5-6/h1-2,5H,3-4,14H2,(H,15,16)
InChIKeyADZKUSFAISZWRX-UHFFFAOYSA-N
MW229.20 g/mol
LogP2.08
Rot. Bonds2

About 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine

2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine (PubChem CID 76846281) has the molecular formula C10H10F3N3 and a molecular weight of 229.20 g/mol. Its IUPAC name is 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine
PubChem CID76846281
Molecular FormulaC10H10F3N3
Molecular Weight229.20 g/mol
Exact Mass229.08
IUPAC Name2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine
SMILESNCCc1[nH]nc2cc(C(F)(F)F)ccc12
InChIInChI=1S/C10H10F3N3/c11-10(12,13)6-1-2-7-8(3-4-14)15-16-9(7)5-6/h1-2,5H,3-4,14H2,(H,15,16)
InChIKeyADZKUSFAISZWRX-UHFFFAOYSA-N
XLogP2.08
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.20
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[6-(trifluoromethyl)-2H-indazol-3-yl]acetonitrile
CID 76846222
2-(6-iodo-2H-indazol-3-yl)ethanamine
CID 76846285
6-(trifluoromethyl)-2H-indazole-3-carbaldehyde
CID 24729230
6-chloro-3-(3,3,3-trifluoropropyl)-2H-indazole
CID 118994156
2-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]ethanamine;hydrochloride
CID 155821832
2-amino-2-[5-(trifluoromethyl)-2H-indazol-3-yl]ethanol
CID 84704974
[3-(trifluoromethyl)-2H-indazol-6-yl]methanamine
CID 105468294
3-(4,4-dimethylpentyl)-6-fluoro-2H-indazole
CID 166973737
2-[1-methyl-5-(trifluoromethyl)benzimidazol-2-yl]ethanamine
CID 46310390
2-(6-amino-2H-indazol-3-yl)acetate
CID 131676345
2-[2,5-bis(trifluoromethyl)-1H-indol-3-yl]ethanamine
CID 125457020
3-(6-fluoro-2H-indazol-3-yl)propanoic acid
CID 83909180

Frequently Asked Questions

What is the IUPAC name of 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine?
The IUPAC name of 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine (CID 76846281) is 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine.
What is the SMILES notation for 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine?
The canonical SMILES for 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine is NCCc1[nH]nc2cc(C(F)(F)F)ccc12.
What is the InChIKey of 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine?
The InChIKey is ADZKUSFAISZWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N3/c11-10(12,13)6-1-2-7-8(3-4-14)15-16-9(7)5-6/h1-2,5H,3-4,14H2,(H,15,16).
What are the key properties of 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine?
2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine has a molecular weight of 229.20 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(trifluoromethyl)-2H-indazol-3-yl]ethanamine is sourced from PubChem (CID 76846281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).