1-[4-(trifluoromethyl)phenyl]indazol-5-amine

C14H10F3N3 — CID 83414547

IUPAC1-[4-(trifluoromethyl)phenyl]indazol-5-amine
SMILESNc1ccc2c(cnn2-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C14H10F3N3/c15-14(16,17)10-1-4-12(5-2-10)20-13-6-3-11(18)7-9(13)8-19-20/h1-8H,18H2
InChIKeyOAJTXGVAAMHEKE-UHFFFAOYSA-N
MW277.25 g/mol
LogP3.63
Rot. Bonds1

About 1-[4-(trifluoromethyl)phenyl]indazol-5-amine

1-[4-(trifluoromethyl)phenyl]indazol-5-amine (PubChem CID 83414547) has the molecular formula C14H10F3N3 and a molecular weight of 277.25 g/mol. Its IUPAC name is 1-[4-(trifluoromethyl)phenyl]indazol-5-amine.

Molecular Properties

Compound Name1-[4-(trifluoromethyl)phenyl]indazol-5-amine
PubChem CID83414547
Molecular FormulaC14H10F3N3
Molecular Weight277.25 g/mol
Exact Mass277.08
IUPAC Name1-[4-(trifluoromethyl)phenyl]indazol-5-amine
SMILESNc1ccc2c(cnn2-c2ccc(C(F)(F)F)cc2)c1
InChIInChI=1S/C14H10F3N3/c15-14(16,17)10-1-4-12(5-2-10)20-13-6-3-11(18)7-9(13)8-19-20/h1-8H,18H2
InChIKeyOAJTXGVAAMHEKE-UHFFFAOYSA-N
XLogP3.63
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.25
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(4-fluorophenyl)indazol-5-amine
CID 59235727
1-phenylindazol-5-amine
CID 83414114
azane;1-[2-chloro-5-(trifluoromethyl)pyrimidin-4-yl]indazol-5-amine
CID 175213889
1-[2-fluoro-4-(trifluoromethyl)phenyl]indazol-6-amine
CID 107303945
1-(4-aminophenyl)pyrazolo[3,4-c]pyridin-5-amine
CID 67112738
2-methyl-1-[4-(trifluoromethyl)phenyl]benzimidazol-5-amine
CID 62506357
1,1,3-trifluoro-2-[1-(4-fluorophenyl)indazol-5-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol
CID 87725211
1-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrazole
CID 11818011
5-ethyl-1-[4-(trifluoromethyl)phenyl]pyrazol-4-amine
CID 75355917
1-amino-1-fluoro-2-[1-(4-fluorophenyl)indazol-5-yl]-3-phenylpropan-2-ol
CID 150429566
3-[1,1,1-trifluoro-2-[1-(4-fluorophenyl)indazol-5-yl]propan-2-yl]benzene-1,2-diamine
CID 91060802
1-[3-(trifluoromethyl)phenyl]indazole
CID 21044942

Frequently Asked Questions

What is the IUPAC name of 1-[4-(trifluoromethyl)phenyl]indazol-5-amine?
The IUPAC name of 1-[4-(trifluoromethyl)phenyl]indazol-5-amine (CID 83414547) is 1-[4-(trifluoromethyl)phenyl]indazol-5-amine.
What is the SMILES notation for 1-[4-(trifluoromethyl)phenyl]indazol-5-amine?
The canonical SMILES for 1-[4-(trifluoromethyl)phenyl]indazol-5-amine is Nc1ccc2c(cnn2-c2ccc(C(F)(F)F)cc2)c1.
What is the InChIKey of 1-[4-(trifluoromethyl)phenyl]indazol-5-amine?
The InChIKey is OAJTXGVAAMHEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3N3/c15-14(16,17)10-1-4-12(5-2-10)20-13-6-3-11(18)7-9(13)8-19-20/h1-8H,18H2.
What are the key properties of 1-[4-(trifluoromethyl)phenyl]indazol-5-amine?
1-[4-(trifluoromethyl)phenyl]indazol-5-amine has a molecular weight of 277.25 g/mol, XLogP of 3.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(trifluoromethyl)phenyl]indazol-5-amine is sourced from PubChem (CID 83414547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).