C151H169N15O15 — CID 88975553
1,1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-hexadecamethyl-1-N,3-N,5-N,7-N,9-N,11-N,13-N,15-N,17-N,19-N,21-N,23-N,25-N,27-N,29-N-pentadecakis-phenyltriacontane-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecacarboxamide (PubChem CID 88975553) has the molecular formula C151H169N15O15 and a molecular weight of 2434.10 g/mol. Its IUPAC name is 1,1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-hexadecamethyl-1-N,3-N,5-N,7-N,9-N,11-N,13-N,15-N,17-N,19-N,21-N,23-N,25-N,27-N,29-N-pentadecakis-phenyltriacontane-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecacarboxamide.
| Compound Name | 1,1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-hexadecamethyl-1-N,3-N,5-N,7-N,9-N,11-N,13-N,15-N,17-N,19-N,21-N,23-N,25-N,27-N,29-N-pentadecakis-phenyltriacontane-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecacarboxamide |
|---|---|
| PubChem CID | 88975553 |
| Molecular Formula | C151H169N15O15 |
| Molecular Weight | 2434.10 g/mol |
| Exact Mass | 2432.29 |
| IUPAC Name | 1,1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-hexadecamethyl-1-N,3-N,5-N,7-N,9-N,11-N,13-N,15-N,17-N,19-N,21-N,23-N,25-N,27-N,29-N-pentadecakis-phenyltriacontane-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29-pentadecacarboxamide |
| SMILES | CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(C)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1 |
| InChI | InChI=1S/C151H169N15O15/c1-137(2,122(167)152-107-63-33-18-34-64-107)93-139(5,124(169)154-109-67-37-20-38-68-109)95-141(7,126(171)156-111-71-41-22-42-72-111)97-143(9,128(173)158-113-75-45-24-46-76-113)99-145(11,130(175)160-115-79-49-26-50-80-115)101-147(13,132(177)162-117-83-53-28-54-84-117)103-149(15,134(179)164-119-87-57-30-58-88-119)105-151(17,136(181)166-121-91-61-32-62-92-121)106-150(16,135(180)165-120-89-59-31-60-90-120)104-148(14,133(178)163-118-85-55-29-56-86-118)102-146(12,131(176)161-116-81-51-27-52-82-116)100-144(10,129(174)159-114-77-47-25-48-78-114)98-142(8,127(172)157-112-73-43-23-44-74-112)96-140(6,125(170)155-110-69-39-21-40-70-110)94-138(3,4)123(168)153-108-65-35-19-36-66-108/h18-92H,93-106H2,1-17H3,(H,152,167)(H,153,168)(H,154,169)(H,155,170)(H,156,171)(H,157,172)(H,158,173)(H,159,174)(H,160,175)(H,161,176)(H,162,177)(H,163,178)(H,164,179)(H,165,180)(H,166,181) |
| InChIKey | FZKARRPEJLXOBG-UHFFFAOYSA-N |
| XLogP | 31.16 |
| TPSA | 436.50 Ų |
| H-Bond Donors | 15 |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 58 |
| Heavy Atoms | 181 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2434.10 |
| LogP ≤ 5 | 31.16 |
| H-Bond Donors ≤ 5 | 15 |
| H-Bond Acceptors ≤ 10 | 15 |