2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide

C26H45N9O9 — CID 176672127

IUPAC2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
SMILESCCNCC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)NCC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)NCC=O
InChIInChI=1S/C26H45N9O9/c1-8-27-11-21(39)32(4)15-25(43)34(6)18-24(42)31(3)14-20(38)29-12-22(40)33(5)16-26(44)35(7)17-23(41)30(2)13-19(37)28-9-10-36/h10,27H,8-9,11-18H2,1-7H3,(H,28,37)(H,29,38)
InChIKeyIORVHJCCPSAQJK-UHFFFAOYSA-N
MW627.70 g/mol
LogP-5.22
Rot. Bonds19

About 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide

2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide (PubChem CID 176672127) has the molecular formula C26H45N9O9 and a molecular weight of 627.70 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
PubChem CID176672127
Molecular FormulaC26H45N9O9
Molecular Weight627.70 g/mol
Exact Mass627.33
IUPAC Name2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
SMILESCCNCC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)NCC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)NCC=O
InChIInChI=1S/C26H45N9O9/c1-8-27-11-21(39)32(4)15-25(43)34(6)18-24(42)31(3)14-20(38)29-12-22(40)33(5)16-26(44)35(7)17-23(41)30(2)13-19(37)28-9-10-36/h10,27H,8-9,11-18H2,1-7H3,(H,28,37)(H,29,38)
InChIKeyIORVHJCCPSAQJK-UHFFFAOYSA-N
XLogP-5.22
TPSA209.16 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds19
Heavy Atoms44
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500627.70
LogP ≤ 5-5.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide with MolForge

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Related Compounds

N-[2-[[2-[[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
CID 176672153
N-[2-(ethylamino)-2-oxoethyl]-N-methyl-2-(propylamino)acetamide
CID 55207779
2-amino-N-[2-[[2-(ethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]acetamide
CID 60963649
N-[2-[[2-[[2-(ethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]amino]-2-oxoethyl]-2-[[2-[formyl(methyl)amino]acetyl]amino]-N-methylacetamide;N-ethylpropan-2-amine;2-[[2-[[2-[formyl(methyl)amino]acetyl]amino]acetyl]-methylamino]acetic acid
CID 176672097
N-methyl-2-(methylamino)-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]acetamide
CID 176959929
N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
CID 177177439
N-methyl-N-[2-oxo-2-(propylamino)ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914805
3-[[2-(ethylamino)-2-oxoethyl]-methylamino]-3-oxopropanoic acid
CID 62230429
2-(butan-2-ylamino)-N-[2-(ethylamino)-2-oxoethyl]-N-methylacetamide
CID 60963182
N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-(propylamino)acetamide
CID 60672011
ethane;2-(ethylamino)-N,N-dimethylacetamide
CID 162757499
N-ethyl-N'-(2-oxoethyl)pentanediamide
CID 138599289

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide (CID 176672127) is 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide is CCNCC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)NCC(=O)N(C)CC(=O)N(C)CC(=O)N(C)CC(=O)NCC=O.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide?
The InChIKey is IORVHJCCPSAQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H45N9O9/c1-8-27-11-21(39)32(4)15-25(43)34(6)18-24(42)31(3)14-20(38)29-12-22(40)33(5)16-26(44)35(7)17-23(41)30(2)13-19(37)28-9-10-36/h10,27H,8-9,11-18H2,1-7H3,(H,28,37)(H,29,38).
What are the key properties of 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide?
2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide has a molecular weight of 627.70 g/mol, XLogP of -5.22, 19 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[[2-[methyl-[2-[methyl-[2-[methyl-[2-oxo-2-(2-oxoethylamino)ethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide is sourced from PubChem (CID 176672127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).