About 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane
8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane (PubChem CID 160519009) has the molecular formula C143H178F4N30S
and a molecular weight of 2425.27 g/mol. Its IUPAC name is 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane.
Frequently Asked Questions
What is the IUPAC name of 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane?
The IUPAC name of 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane (CID 160519009) is 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane.
What is the SMILES notation for 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane?
The canonical SMILES for 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane is C.CCC(CC)CNc1nc(Nc2ccc(F)c(C)c2)nc2c(C#N)cccc12.CCC(CC)CNc1nc(Nc2ccc(F)c(C)c2)nc2c(C#N)cccc12.C[C@@H](Nc1nc(NCC2CCCCC2)nc2c(CN)cccc12)c1cccs1.Cc1cc(C)cc(Nc2nc(N[C@H](C)C(C)(C)C)c3cccc(C4=CCNCC4)c3n2)c1.Cc1cc(F)cc(Nc2nc(N[C@H](C)C(C)(C)C)c3cccc(CCN)c3n2)c1.Cc1cc(Nc2nc(N[C@H](C)C(C)(C)C)c3cccc(C4=CCNCC4)c3n2)ccc1F.
What is the InChIKey of 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane?
The InChIKey is QUAIFBANNVRQIC-JYNNLTQRSA-N. The full InChI is InChI=1S/C27H35N5.C26H32FN5.C23H30FN5.2C22H24FN5.C22H29N5S.CH4/c1-17-14-18(2)16-21(15-17)30-26-31-24-22(20-10-12-28-13-11-20)8-7-9-23(24)25(32-26)29-19(3)27(4,5)6;1-16-15-19(9-10-22(16)27)30-25-31-23-20(18-11-13-28-14-12-18)7-6-8-21(23)24(32-25)29-17(2)26(3,4)5;1-14-11-17(24)13-18(12-14)27-22-28-20-16(9-10-25)7-6-8-19(20)21(29-22)26-15(2)23(3,4)5;2*1-4-15(5-2)13-25-21-18-8-6-7-16(12-24)20(18)27-22(28-21)26-17-9-10-19(23)14(3)11-17;1-15(19-11-6-12-28-19)25-21-18-10-5-9-17(13-23)20(18)26-22(27-21)24-14-16-7-3-2-4-8-16;/h7-10,14-16,19,28H,11-13H2,1-6H3,(H2,29,30,31,32);6-11,15,17,28H,12-14H2,1-5H3,(H2,29,30,31,32);6-8,11-13,15H,9-10,25H2,1-5H3,(H2,26,27,28,29);2*6-11,15H,4-5,13H2,1-3H3,(H2,25,26,27,28);5-6,9-12,15-16H,2-4,7-8,13-14,23H2,1H3,(H2,24,25,26,27);1H4/t19-;17-;15-;;;15-;/m111..1./s1.
What are the key properties of 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane?
8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane has a molecular weight of 2425.27 g/mol, XLogP of 34.46, 37 rotatable bonds, 16 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-aminoethyl)-4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3-fluoro-5-methylphenyl)quinazoline-2,4-diamine;8-(aminomethyl)-2-N-(cyclohexylmethyl)-4-N-[(1R)-1-thiophen-2-ylethyl]quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(3,5-dimethylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;4-N-[(2R)-3,3-dimethylbutan-2-yl]-2-N-(4-fluoro-3-methylphenyl)-8-(1,2,3,6-tetrahydropyridin-4-yl)quinazoline-2,4-diamine;bis(4-(2-ethylbutylamino)-2-(4-fluoro-3-methylanilino)quinazoline-8-carbonitrile);methane is sourced from PubChem (CID 160519009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).