N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine

C9H8F3N3 — CID 102049744

IUPACN-(2,2,2-trifluoroethyl)-1H-indazol-5-amine
SMILESFC(F)(F)CNc1ccc2[nH]ncc2c1
InChIInChI=1S/C9H8F3N3/c10-9(11,12)5-13-7-1-2-8-6(3-7)4-14-15-8/h1-4,13H,5H2,(H,14,15)
InChIKeyLOGYZXLFKFLNQE-UHFFFAOYSA-N
MW215.18 g/mol
LogP2.54
Rot. Bonds2

About N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine

N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine (PubChem CID 102049744) has the molecular formula C9H8F3N3 and a molecular weight of 215.18 g/mol. Its IUPAC name is N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine.

Molecular Properties

Compound NameN-(2,2,2-trifluoroethyl)-1H-indazol-5-amine
PubChem CID102049744
Molecular FormulaC9H8F3N3
Molecular Weight215.18 g/mol
Exact Mass215.07
IUPAC NameN-(2,2,2-trifluoroethyl)-1H-indazol-5-amine
SMILESFC(F)(F)CNc1ccc2[nH]ncc2c1
InChIInChI=1S/C9H8F3N3/c10-9(11,12)5-13-7-1-2-8-6(3-7)4-14-15-8/h1-4,13H,5H2,(H,14,15)
InChIKeyLOGYZXLFKFLNQE-UHFFFAOYSA-N
XLogP2.54
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.18
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-indazol-5-amine
CID 162568313
N-(3-methylsulfanylpropyl)-1H-indazol-5-amine
CID 43690828
N-[(4-tert-butylphenyl)methyl]-1H-indazol-5-amine
CID 43231004
N-(4-fluorophenyl)-1H-indazol-5-amine
CID 91229030
N-[5-(1H-indazol-5-ylamino)pentyl]-2-methylpropane-2-sulfonamide
CID 70939628
N-[(4-ethylphenyl)methyl]-1H-indazol-5-amine
CID 43690856
4-[(1H-indazol-5-ylamino)methyl]benzoic acid
CID 65347918
N-(1H-indazol-5-yl)-4,4-dimethylpentanamide
CID 155236090
N-[(2,4,5-trimethylphenyl)methyl]-1H-indazol-5-amine
CID 43782695
N-(naphthalen-2-ylmethyl)-1H-indazol-5-amine
CID 762796
N-(anthracen-9-ylmethyl)-1H-indazol-5-amine
CID 784305
N-(thiophen-3-ylmethyl)-1H-indazol-5-amine
CID 43690874

Frequently Asked Questions

What is the IUPAC name of N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine?
The IUPAC name of N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine (CID 102049744) is N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine.
What is the SMILES notation for N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine?
The canonical SMILES for N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine is FC(F)(F)CNc1ccc2[nH]ncc2c1.
What is the InChIKey of N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine?
The InChIKey is LOGYZXLFKFLNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3/c10-9(11,12)5-13-7-1-2-8-6(3-7)4-14-15-8/h1-4,13H,5H2,(H,14,15).
What are the key properties of N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine?
N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine has a molecular weight of 215.18 g/mol, XLogP of 2.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,2-trifluoroethyl)-1H-indazol-5-amine is sourced from PubChem (CID 102049744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).