7-(trifluoromethyl)quinoxalin-5-amine

C9H6F3N3 — CID 151759354

IUPAC7-(trifluoromethyl)quinoxalin-5-amine
SMILESNc1cc(C(F)(F)F)cc2nccnc12
InChIInChI=1S/C9H6F3N3/c10-9(11,12)5-3-6(13)8-7(4-5)14-1-2-15-8/h1-4H,13H2
InChIKeyRQFRFZIXAWCOIS-UHFFFAOYSA-N
MW213.16 g/mol
LogP2.23
Rot. Bonds

About 7-(trifluoromethyl)quinoxalin-5-amine

7-(trifluoromethyl)quinoxalin-5-amine (PubChem CID 151759354) has the molecular formula C9H6F3N3 and a molecular weight of 213.16 g/mol. Its IUPAC name is 7-(trifluoromethyl)quinoxalin-5-amine.

Molecular Properties

Compound Name7-(trifluoromethyl)quinoxalin-5-amine
PubChem CID151759354
Molecular FormulaC9H6F3N3
Molecular Weight213.16 g/mol
Exact Mass213.05
IUPAC Name7-(trifluoromethyl)quinoxalin-5-amine
SMILESNc1cc(C(F)(F)F)cc2nccnc12
InChIInChI=1S/C9H6F3N3/c10-9(11,12)5-3-6(13)8-7(4-5)14-1-2-15-8/h1-4H,13H2
InChIKeyRQFRFZIXAWCOIS-UHFFFAOYSA-N
XLogP2.23
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.16
LogP ≤ 52.23
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

8-bromo-3-(trifluoromethyl)-1,5-naphthyridine
CID 15654587
2-pyrazin-2-yl-5-(trifluoromethyl)aniline
CID 114043499
2,3-diamino-5-(trifluoromethyl)phenol
CID 142974486
2-propan-2-yl-5-(trifluoromethyl)-1,3-benzoxazol-7-amine
CID 82232029
7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine
CID 150983052
2-chloro-3,5-bis(trifluoromethyl)aniline
CID 2757429
2-amino-4-(trifluoromethyl)benzenethiol;hydron;chloride
CID 51064124
2-(pyrimidin-2-ylmethylsulfanyl)-5-(trifluoromethyl)aniline
CID 55108394
3-(trifluoromethyl)bicyclo[3.1.0]hexa-1,3,5-trien-6-amine
CID 174741615
4-chloro-7-(trifluoromethyl)quinolin-3-amine
CID 133061186
[7-(trifluoromethyl)quinolin-4-yl]hydrazine
CID 15585954
7-(trifluoromethyl)pyrido[1,2-a]benzimidazol-9-amine
CID 91738636

Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)quinoxalin-5-amine?
The IUPAC name of 7-(trifluoromethyl)quinoxalin-5-amine (CID 151759354) is 7-(trifluoromethyl)quinoxalin-5-amine.
What is the SMILES notation for 7-(trifluoromethyl)quinoxalin-5-amine?
The canonical SMILES for 7-(trifluoromethyl)quinoxalin-5-amine is Nc1cc(C(F)(F)F)cc2nccnc12.
What is the InChIKey of 7-(trifluoromethyl)quinoxalin-5-amine?
The InChIKey is RQFRFZIXAWCOIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F3N3/c10-9(11,12)5-3-6(13)8-7(4-5)14-1-2-15-8/h1-4H,13H2.
What are the key properties of 7-(trifluoromethyl)quinoxalin-5-amine?
7-(trifluoromethyl)quinoxalin-5-amine has a molecular weight of 213.16 g/mol, XLogP of 2.23, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)quinoxalin-5-amine is sourced from PubChem (CID 151759354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).