About (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine
(2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine (PubChem CID 159443642) has the molecular formula C155H168Cl2I2N32O28
and a molecular weight of 3251.96 g/mol. Its IUPAC name is (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine.
Frequently Asked Questions
What is the IUPAC name of (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine?
The IUPAC name of (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine (CID 159443642) is (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine.
What is the SMILES notation for (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine?
The canonical SMILES for (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine is CN1CCC(N)CC1.CN1CCC(N2C(=O)c3cc(N)c(N)cc3C2=O)CC1.CN1CCC(N2C(=O)c3cc(N)c([N+](=O)[O-])cc3C2=O)CC1.CN1CCC(N2C(=O)c3cc4c(cc3C2=O)N=C(c2c(Cl)cc[nH]c2=O)C4)CC1.COc1nccc(I)c1C1=Nc2cc3c(cc2C1)C(=O)N(C1CCN(C)CC1)C3=O.COc1nccc(I)c1C=O.Cc1ccc(OC[C@H](O)CN)c(C)c1.Cc1ccc(OC[C@H](O)CNc2cc[nH]c(=O)c2C2=Nc3cc4c(cc3C2)C(=O)N(C2CCN(C)CC2)C4=O)c(C)c1.Nc1cc2c(cc1[N+](=O)[O-])C(=O)NC2=O.O=C1c2cc3c(cc2C(=O)N1C1CCNCC1)N=C(c1c(Cl)cc[nH]c1=O)C3.
What is the InChIKey of (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine?
The InChIKey is LSMHFTNHRDKUNZ-IMJWALIDSA-N. The full InChI is InChI=1S/C32H35N5O5.C22H21IN4O3.C21H19ClN4O3.C20H17ClN4O3.C14H16N4O4.C14H18N4O2.C11H17NO2.C8H5N3O4.C7H6INO2.C6H14N2/c1-18-4-5-28(19(2)12-18)42-17-22(38)16-34-25-6-9-33-30(39)29(25)27-14-20-13-23-24(15-26(20)35-27)32(41)37(31(23)40)21-7-10-36(3)11-8-21;1-26-7-4-13(5-8-26)27-21(28)14-9-12-10-18(25-17(12)11-15(14)22(27)29)19-16(23)3-6-24-20(19)30-2;1-25-6-3-12(4-7-25)26-20(28)13-8-11-9-17(18-15(22)2-5-23-19(18)27)24-16(11)10-14(13)21(26)29;21-14-3-6-23-18(26)17(14)16-8-10-7-12-13(9-15(10)24-16)20(28)25(19(12)27)11-1-4-22-5-2-11;1-16-4-2-8(3-5-16)17-13(19)9-6-11(15)12(18(21)22)7-10(9)14(17)20;1-17-4-2-8(3-5-17)18-13(19)9-6-11(15)12(16)7-10(9)14(18)20;1-8-3-4-11(9(2)5-8)14-7-10(13)6-12;9-5-1-3-4(2-6(5)11(14)15)8(13)10-7(3)12;1-11-7-5(4-10)6(8)2-3-9-7;1-8-4-2-6(7)3-5-8/h4-6,9,12-13,15,21-22,38H,7-8,10-11,14,16-17H2,1-3H3,(H2,33,34,39);3,6,9,11,13H,4-5,7-8,10H2,1-2H3;2,5,8,10,12H,3-4,6-7,9H2,1H3,(H,23,27);3,6-7,9,11,22H,1-2,4-5,8H2,(H,23,26);6-8H,2-5,15H2,1H3;6-8H,2-5,15-16H2,1H3;3-5,10,13H,6-7,12H2,1-2H3;1-2H,9H2,(H,10,12,13);2-4H,1H3;6H,2-5,7H2,1H3/t22-;;;;;;10-;;;/m1.....1.../s1.
What are the key properties of (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine?
(2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine has a molecular weight of 3251.96 g/mol, XLogP of 14.74, 25 rotatable bonds, 14 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-amino-3-(2,4-dimethylphenoxy)propan-2-ol;5-amino-2-(1-methylpiperidin-4-yl)-6-nitroisoindole-1,3-dione;5-amino-6-nitroisoindole-1,3-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;2-(4-chloro-2-oxo-1H-pyridin-3-yl)-6-piperidin-4-yl-3H-pyrrolo[3,4-f]indole-5,7-dione;5,6-diamino-2-(1-methylpiperidin-4-yl)isoindole-1,3-dione;2-[4-[[(2R)-3-(2,4-dimethylphenoxy)-2-hydroxypropyl]amino]-2-oxo-1H-pyridin-3-yl]-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;4-iodo-2-methoxypyridine-3-carbaldehyde;2-(4-iodo-2-methoxy-3-pyridinyl)-6-(1-methylpiperidin-4-yl)-3H-pyrrolo[3,4-f]indole-5,7-dione;1-methylpiperidin-4-amine is sourced from PubChem (CID 159443642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).