6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine

C8H11F3N4 — CID 90391842

IUPAC6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine
SMILESCC(C)Nc1cnc(C(F)(F)F)c(N)n1
InChIInChI=1S/C8H11F3N4/c1-4(2)14-5-3-13-6(7(12)15-5)8(9,10)11/h3-4H,1-2H3,(H3,12,14,15)
InChIKeyUZRAOWURFCTSTP-UHFFFAOYSA-N
MW220.20 g/mol
LogP1.90
Rot. Bonds2

About 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine

6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine (PubChem CID 90391842) has the molecular formula C8H11F3N4 and a molecular weight of 220.20 g/mol. Its IUPAC name is 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine
PubChem CID90391842
Molecular FormulaC8H11F3N4
Molecular Weight220.20 g/mol
Exact Mass220.09
IUPAC Name6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine
SMILESCC(C)Nc1cnc(C(F)(F)F)c(N)n1
InChIInChI=1S/C8H11F3N4/c1-4(2)14-5-3-13-6(7(12)15-5)8(9,10)11/h3-4H,1-2H3,(H3,12,14,15)
InChIKeyUZRAOWURFCTSTP-UHFFFAOYSA-N
XLogP1.90
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(Cyclohexylamino)pyrazine-2-carbonitrile
CID 16108898
3-(Methylamino)pyrazine-2-carbonitrile
CID 821140
2-Methyl-3-(piperazin-1-yl)pyrazine
CID 45099710
2-Methyl-6-piperazin-1-ylpyrazine;hydrochloride
CID 90674676
5,6-Dimethylpyrazin-2-amine
CID 222763
N,3-Dimethylpyrazin-2-amine
CID 44327445
N,N,3,6-tetramethylpyrazin-2-amine
CID 8009163
3-(Piperazin-1-yl)pyrazine-2-carbonitrile
CID 2760441
6-(Trifluoromethyl)pyrazin-2-amine
CID 13341114
5-(Trifluoromethyl)pyrazin-2-amine
CID 13341115
3-(Trifluoromethyl)pyrazin-2-amine
CID 25069463
8-methyl-2-(trifluoromethyl)-5H,6H,7H,8H-imidazo(1,2-a)pyrazine
CID 45480427

Frequently Asked Questions

What is the IUPAC name of 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine (CID 90391842) is 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine is CC(C)Nc1cnc(C(F)(F)F)c(N)n1.
What is the InChIKey of 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine?
The InChIKey is UZRAOWURFCTSTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4/c1-4(2)14-5-3-13-6(7(12)15-5)8(9,10)11/h3-4H,1-2H3,(H3,12,14,15).
What are the key properties of 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine?
6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine has a molecular weight of 220.20 g/mol, XLogP of 1.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-propan-2-yl-3-(trifluoromethyl)pyrazine-2,6-diamine is sourced from PubChem (CID 90391842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).