N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine

C14H10F3N3 — CID 45484867

IUPACN-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine
SMILESFC(F)(F)c1ccc(Nc2n[nH]c3ccccc23)cc1
InChIInChI=1S/C14H10F3N3/c15-14(16,17)9-5-7-10(8-6-9)18-13-11-3-1-2-4-12(11)19-20-13/h1-8H,(H2,18,19,20)
InChIKeyAFRZNTCTQMQYMM-UHFFFAOYSA-N
MW277.25 g/mol
LogP4.33
Rot. Bonds2

About N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine

N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine (PubChem CID 45484867) has the molecular formula C14H10F3N3 and a molecular weight of 277.25 g/mol. Its IUPAC name is N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine.

Molecular Properties

Compound NameN-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine
PubChem CID45484867
Molecular FormulaC14H10F3N3
Molecular Weight277.25 g/mol
Exact Mass277.08
IUPAC NameN-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine
SMILESFC(F)(F)c1ccc(Nc2n[nH]c3ccccc23)cc1
InChIInChI=1S/C14H10F3N3/c15-14(16,17)9-5-7-10(8-6-9)18-13-11-3-1-2-4-12(11)19-20-13/h1-8H,(H2,18,19,20)
InChIKeyAFRZNTCTQMQYMM-UHFFFAOYSA-N
XLogP4.33
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.25
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine?
The IUPAC name of N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine (CID 45484867) is N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine.
What is the SMILES notation for N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine?
The canonical SMILES for N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine is FC(F)(F)c1ccc(Nc2n[nH]c3ccccc23)cc1.
What is the InChIKey of N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine?
The InChIKey is AFRZNTCTQMQYMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3N3/c15-14(16,17)9-5-7-10(8-6-9)18-13-11-3-1-2-4-12(11)19-20-13/h1-8H,(H2,18,19,20).
What are the key properties of N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine?
N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine has a molecular weight of 277.25 g/mol, XLogP of 4.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(trifluoromethyl)phenyl]-1H-indazol-3-amine is sourced from PubChem (CID 45484867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).