About 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine
2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine (PubChem CID 158439695) has the molecular formula C99H107Cl2F3N22O9
and a molecular weight of 1876.99 g/mol. Its IUPAC name is 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine.
Analyze 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine with MolForge
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Frequently Asked Questions
What is the IUPAC name of 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine?
The IUPAC name of 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine (CID 158439695) is 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine.
What is the SMILES notation for 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine?
The canonical SMILES for 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine is CCCN(c1ccc2ncc(-c3cnn(C)c3)nc2c1)c1cc(OC)cc(OC)c1Cl.CCCN(c1ccc2ncc(-c3cnn(C)c3)nc2c1)c1cc(OC)cc(OC)c1Cl.COc1cc(OC)cc(N(CCCN2CCC(F)(F)C2)c2ccc3ncc(-c4cnn(C5CCCCO5)c4)nc3c2)c1.Cn1cc(-c2cnc3ccc(N(CCN)c4cc(F)cc(OCCO)c4)cc3n2)cn1.
What is the InChIKey of 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine?
The InChIKey is HCQVKOFEVKUAOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H36F2N6O3.2C23H24ClN5O2.C22H23FN6O2/c1-40-25-14-24(15-26(17-25)41-2)38(11-5-10-37-12-9-31(32,33)21-37)23-7-8-27-28(16-23)36-29(19-34-27)22-18-35-39(20-22)30-6-3-4-13-42-30;2*1-5-8-29(21-10-17(30-3)11-22(31-4)23(21)24)16-6-7-18-19(9-16)27-20(13-25-18)15-12-26-28(2)14-15;1-28-14-15(12-26-28)22-13-25-20-3-2-17(11-21(20)27-22)29(5-4-24)18-8-16(23)9-19(10-18)31-7-6-30/h7-8,14-20,30H,3-6,9-13,21H2,1-2H3;2*6-7,9-14H,5,8H2,1-4H3;2-3,8-14,30H,4-7,24H2,1H3.
What are the key properties of 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine?
2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine has a molecular weight of 1876.99 g/mol, XLogP of 19.21, 32 rotatable bonds, 2 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[2-aminoethyl-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]amino]-5-fluorophenoxy]ethanol;bis(N-(2-chloro-3,5-dimethoxyphenyl)-3-(1-methylpyrazol-4-yl)-N-propylquinoxalin-6-amine);N-[3-(3,3-difluoropyrrolidin-1-yl)propyl]-N-(3,5-dimethoxyphenyl)-3-[1-(oxan-2-yl)pyrazol-4-yl]quinoxalin-6-amine is sourced from PubChem (CID 158439695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).