N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide

C59H109N11O15 — CID 134565490

About N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide

N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide (PubChem CID 134565490) has the molecular formula C59H109N11O15 and a molecular weight of 1212.58 g/mol. Its IUPAC name is N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide.

Molecular Properties

• Compound Name: N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide
• PubChem CID: 134565490
• Molecular Formula: C59H109N11O15
• Molecular Weight: 1212.58 g/mol
• Exact Mass: 1211.81
• IUPAC Name: N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide
• SMILES: CCC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(N)=O)CC(C)O)C(C)CC)C(C)CC)C(C)CC)CC(C)O)CC(C)O)CC(C)O)C(C)CC)C(C)CC)C(C)CC
• InChI: InChI=1S/C59H109N11O15/c1-18-39(8)65(50(76)24-7)35-56(82)69(43(12)22-5)37-58(84)67(41(10)20-3)34-54(80)63(27-47(16)73)31-51(77)62(26-46(15)72)30-52(78)64(28-48(17)74)32-55(81)68(42(11)21-4)36-59(85)70(44(13)23-6)38-57(83)66(40(9)19-2)33-53(79)61(25-45(14)71)29-49(60)75/h39-48,71-74H,18-38H2,1-17H3,(H2,60,75)
• InChIKey: GCUHDNSXPZBNTK-UHFFFAOYSA-N
• XLogP: 0.48
• TPSA: 327.11 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 15
• Rotatable Bonds: 41
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1212.58
LogP ≤ 5	0.48
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide?

The IUPAC name of N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide (CID 134565490) is N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide.

What is the SMILES notation for N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide?

The canonical SMILES for N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide is CCC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(=O)N(CC(N)=O)CC(C)O)C(C)CC)C(C)CC)C(C)CC)CC(C)O)CC(C)O)CC(C)O)C(C)CC)C(C)CC)C(C)CC.

What is the InChIKey of N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide?

The InChIKey is GCUHDNSXPZBNTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H109N11O15/c1-18-39(8)65(50(76)24-7)35-56(82)69(43(12)22-5)37-58(84)67(41(10)20-3)34-54(80)63(27-47(16)73)31-51(77)62(26-46(15)72)30-52(78)64(28-48(17)74)32-55(81)68(42(11)21-4)36-59(85)70(44(13)23-6)38-57(83)66(40(9)19-2)33-53(79)61(25-45(14)71)29-49(60)75/h39-48,71-74H,18-38H2,1-17H3,(H2,60,75).

What are the key properties of N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide?

N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide has a molecular weight of 1212.58 g/mol, XLogP of 0.48, 41 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-2-oxoethyl)-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-(2-hydroxypropyl)amino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-butan-2-ylamino]-2-oxoethyl]-N-butan-2-ylpropanamide is sourced from PubChem (CID 134565490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).