C203H295F3N8 — CID 159114148
N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)-N-methylmethanamine;N-(1-adamantylmethyl)-N-methyl-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(3-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-1-(4-propan-2-ylphenyl)methanamine;1-[4-fluoro-2-[(4-propan-2-ylphenyl)methyl]butyl]adamantane;N-[(3-propan-2-ylphenyl)methyl]adamantan-1-amine (PubChem CID 159114148) has the molecular formula C203H295F3N8 and a molecular weight of 2904.64 g/mol. Its IUPAC name is N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)-N-methylmethanamine;N-(1-adamantylmethyl)-N-methyl-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(3-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-1-(4-propan-2-ylphenyl)methanamine;1-[4-fluoro-2-[(4-propan-2-ylphenyl)methyl]butyl]adamantane;N-[(3-propan-2-ylphenyl)methyl]adamantan-1-amine.
| Compound Name | N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)-N-methylmethanamine;N-(1-adamantylmethyl)-N-methyl-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(3-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-1-(4-propan-2-ylphenyl)methanamine;1-[4-fluoro-2-[(4-propan-2-ylphenyl)methyl]butyl]adamantane;N-[(3-propan-2-ylphenyl)methyl]adamantan-1-amine |
|---|---|
| PubChem CID | 159114148 |
| Molecular Formula | C203H295F3N8 |
| Molecular Weight | 2904.64 g/mol |
| Exact Mass | 2902.33 |
| IUPAC Name | N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(2-fluoro-4-propan-2-ylphenyl)-N-methylmethanamine;N-(1-adamantylmethyl)-N-methyl-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(3-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine;N-(1-adamantylmethyl)-1-(6-propan-2-yl-7,8-dihydronaphthalen-2-yl)methanamine;N-(1-adamantylmethyl)-1-(4-propan-2-ylphenyl)methanamine;1-[4-fluoro-2-[(4-propan-2-ylphenyl)methyl]butyl]adamantane;N-[(3-propan-2-ylphenyl)methyl]adamantan-1-amine |
| SMILES | CC(C)C1=Cc2ccc(CN(C)CC34CC5CC(CC(C5)C3)C4)cc2CC1.CC(C)C1=Cc2ccc(CNCC34CC5CC(CC(C5)C3)C4)cc2CC1.CC(C)c1ccc(CC(CCF)CC23CC4CC(CC(C4)C2)C3)cc1.CC(C)c1ccc(CN(C)CC23CC4CC(CC(C4)C2)C3)c(F)c1.CC(C)c1ccc(CN(C)CC23CC4CC(CC(C4)C2)C3)cc1.CC(C)c1ccc(CNCC23CC4CC(CC(C4)C2)C3)c(F)c1.CC(C)c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1.CC(C)c1cccc(CN(C)CC23CC4CC(CC(C4)C2)C3)c1.CC(C)c1cccc(CNC23CC4CC(CC(C4)C2)C3)c1 |
| InChI | InChI=1S/C26H37N.C25H35N.C24H35F.C22H32FN.2C22H33N.C21H30FN.C21H31N.C20H29N/c1-18(2)23-6-7-24-11-19(4-5-25(24)12-23)16-27(3)17-26-13-20-8-21(14-26)10-22(9-20)15-26;1-17(2)22-5-6-23-10-18(3-4-24(23)11-22)15-26-16-25-12-19-7-20(13-25)9-21(8-19)14-25;1-17(2)23-5-3-18(4-6-23)9-19(7-8-25)13-24-14-20-10-21(15-24)12-22(11-20)16-24;1-15(2)19-4-5-20(21(23)9-19)13-24(3)14-22-10-16-6-17(11-22)8-18(7-16)12-22;1-16(2)21-6-4-17(5-7-21)14-23(3)15-22-11-18-8-19(12-22)10-20(9-18)13-22;1-16(2)21-6-4-5-17(10-21)14-23(3)15-22-11-18-7-19(12-22)9-20(8-18)13-22;1-14(2)18-3-4-19(20(22)8-18)12-23-13-21-9-15-5-16(10-21)7-17(6-15)11-21;1-15(2)20-5-3-16(4-6-20)13-22-14-21-10-17-7-18(11-21)9-19(8-17)12-21;1-14(2)19-5-3-4-15(9-19)13-21-20-10-16-6-17(11-20)8-18(7-16)12-20/h4-5,11-12,18,20-22H,6-10,13-17H2,1-3H3;3-4,10-11,17,19-21,26H,5-9,12-16H2,1-2H3;3-6,17,19-22H,7-16H2,1-2H3;4-5,9,15-18H,6-8,10-14H2,1-3H3;4-7,16,18-20H,8-15H2,1-3H3;4-6,10,16,18-20H,7-9,11-15H2,1-3H3;3-4,8,14-17,23H,5-7,9-13H2,1-2H3;3-6,15,17-19,22H,7-14H2,1-2H3;3-5,9,14,16-18,21H,6-8,10-13H2,1-2H3 |
| InChIKey | KEWGFSQQBPEIJJ-UHFFFAOYSA-N |
| XLogP | 50.99 |
| TPSA | 61.08 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 46 |
| Heavy Atoms | 214 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2904.64 |
| LogP ≤ 5 | 50.99 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 8 |