5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine

C33H24F8N10 — CID 158113892

IUPAC5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine
SMILESCC(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C(F)(F)F.Fc1cnccc1-c1ncc(NCC(F)(F)F)nc1-c1cccnc1
InChIInChI=1S/C17H13F4N5.C16H11F4N5/c1-10(17(19,20)21)25-14-9-24-16(12-4-6-23-8-13(12)18)15(26-14)11-3-2-5-22-7-11;17-12-7-22-5-3-11(12)15-14(10-2-1-4-21-6-10)25-13(8-23-15)24-9-16(18,19)20/h2-10H,1H3,(H,25,26);1-8H,9H2,(H,24,25)
InChIKeyFQTOIGNXEVVCPJ-UHFFFAOYSA-N
MW712.61 g/mol
LogP7.82
Rot. Bonds8

About 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine

5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine (PubChem CID 158113892) has the molecular formula C33H24F8N10 and a molecular weight of 712.61 g/mol. Its IUPAC name is 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine.

Molecular Properties

Compound Name5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine
PubChem CID158113892
Molecular FormulaC33H24F8N10
Molecular Weight712.61 g/mol
Exact Mass712.21
IUPAC Name5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine
SMILESCC(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C(F)(F)F.Fc1cnccc1-c1ncc(NCC(F)(F)F)nc1-c1cccnc1
InChIInChI=1S/C17H13F4N5.C16H11F4N5/c1-10(17(19,20)21)25-14-9-24-16(12-4-6-23-8-13(12)18)15(26-14)11-3-2-5-22-7-11;17-12-7-22-5-3-11(12)15-14(10-2-1-4-21-6-10)25-13(8-23-15)24-9-16(18,19)20/h2-10H,1H3,(H,25,26);1-8H,9H2,(H,24,25)
InChIKeyFQTOIGNXEVVCPJ-UHFFFAOYSA-N
XLogP7.82
TPSA127.18 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500712.61
LogP ≤ 57.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

Cyclohexyl-(4-(1-piperazin-1-yl(2,6)naphthyridin-3-yl)pyridin-2-yl)amine
CID 25020250
N-{6-[3-(Piperazin-1-Yl)phenyl]pyridin-2-Yl}-4-(Trifluoromethyl)pyridin-2-Amine
CID 56947354
2-Methyl-N~1~-[3-(Pyridin-4-Yl)-2,6-Naphthyridin-1-Yl]propane-1,2-Diamine
CID 24996161
7-[6-(Dimethylamino)pyridin-3-Yl]-~{n}-[[(3~{s})-Piperidin-3-Yl]methyl]pyrido[3,4-B]pyrazin-5-Amine
CID 66555698
3-{4-[(2,4-difluorophenyl)methyl]piperazin-1-yl}-7-methyl-N-(propan-2-yl)pyrido[3,4-b]pyrazin-2-amine
CID 118310209
(4-Trifluoromethylphenyl)-[7-(3-trifluoromethylpyridin-2-yl)-pyrido[3,2-d]pyrimidin-4-yl]amine
CID 10151288
4-(2,4-difluorophenyl)-8-(2,6-difluorophenyl)-7-oxido-N-piperidin-4-yl-1,7-naphthyridin-7-ium-2-amine
CID 24898751
3-(3-(trifluoromethyl)pyridin-2-yl)-N-(5-(trifluoromethyl)pyridin-2-yl)pyrido[2,3-b]pyrazin-8-amine
CID 46203867
1-[3-(2-Cyclohexylaminopyridin-4-yl)[2,6]naphthyridin-1-yl]-piperidine-4-carboxylic Acid Piperidin-4-ylamide
CID 46900230
2'-Fluoro-3-methyl-N-[5-(2-pyrazinyl)-2-pyridinyl][2,4'-bipyridine]-5-acetamide
CID 46927364
6-N-[5-[4-(dimethylamino)piperidin-1-yl]-2-pyridinyl]-2-N-phenyl-4-piperidin-1-ylpyrido[3,4-d]pyrimidine-2,6-diamine
CID 145975282
6-(3-piperazin-4-ium-1-ylphenyl)-N-[4-(trifluoromethyl)pyridin-2-yl]pyridin-2-amine
CID 72200762

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine?
The IUPAC name of 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine (CID 158113892) is 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine.
What is the SMILES notation for 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine?
The canonical SMILES for 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine is CC(Nc1cnc(-c2ccncc2F)c(-c2cccnc2)n1)C(F)(F)F.Fc1cnccc1-c1ncc(NCC(F)(F)F)nc1-c1cccnc1.
What is the InChIKey of 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine?
The InChIKey is FQTOIGNXEVVCPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F4N5.C16H11F4N5/c1-10(17(19,20)21)25-14-9-24-16(12-4-6-23-8-13(12)18)15(26-14)11-3-2-5-22-7-11;17-12-7-22-5-3-11(12)15-14(10-2-1-4-21-6-10)25-13(8-23-15)24-9-16(18,19)20/h2-10H,1H3,(H,25,26);1-8H,9H2,(H,24,25).
What are the key properties of 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine?
5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine has a molecular weight of 712.61 g/mol, XLogP of 7.82, 8 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine;5-(3-fluoro-4-pyridinyl)-6-pyridin-3-yl-N-(1,1,1-trifluoropropan-2-yl)pyrazin-2-amine is sourced from PubChem (CID 158113892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).