7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten

C101H203N7O37W6 — CID 159536331

IUPAC7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten
SMILESC.C.C.CCCCOCCOCCOCCCCC(=O)CC.CCCOCCOCC(=O)CCCOCCOCC(=O)NCC.CCCOCCOCC(=O)CCCOCCOCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)NCC.CCCOCCOCC(=O)NC.CCCOCCOCC(=O)NC.CCCOCCOCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)NCC.[W].[W].[W].[W].[W].[W]
InChIInChI=1S/C29H54N2O12.C22H42N2O9.C16H31NO6.C15H30O4.2C8H17NO3.3CH4.6W/c1-3-10-36-14-18-40-22-26(32)7-5-12-38-16-21-43-25-29(35)31-9-13-39-17-19-41-23-27(33)8-6-11-37-15-20-42-24-28(34)30-4-2;1-3-8-28-11-15-33-19-22(27)24-7-10-30-13-14-31-17-20(25)6-5-9-29-12-16-32-18-21(26)23-4-2;1-3-7-20-9-11-22-13-15(18)6-5-8-21-10-12-23-14-16(19)17-4-2;1-3-5-9-17-11-13-19-14-12-18-10-7-6-8-15(16)4-2;2*1-3-4-11-5-6-12-7-8(10)9-2;;;;;;;;;/h3-25H2,1-2H3,(H,30,34)(H,31,35);3-19H2,1-2H3,(H,23,26)(H,24,27);3-14H2,1-2H3,(H,17,19);3-14H2,1-2H3;2*3-7H2,1-2H3,(H,9,10);3*1H4;;;;;;
InChIKeyMDQFHISLVUBFSR-UHFFFAOYSA-N
MW3210.79 g/mol
LogP6.76
Rot. Bonds105

About 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten

7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten (PubChem CID 159536331) has the molecular formula C101H203N7O37W6 and a molecular weight of 3210.79 g/mol. Its IUPAC name is 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten.

Molecular Properties

Compound Name7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten
PubChem CID159536331
Molecular FormulaC101H203N7O37W6
Molecular Weight3210.79 g/mol
Exact Mass3210.13
IUPAC Name7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten
SMILESC.C.C.CCCCOCCOCCOCCCCC(=O)CC.CCCOCCOCC(=O)CCCOCCOCC(=O)NCC.CCCOCCOCC(=O)CCCOCCOCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)NCC.CCCOCCOCC(=O)NC.CCCOCCOCC(=O)NC.CCCOCCOCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)NCC.[W].[W].[W].[W].[W].[W]
InChIInChI=1S/C29H54N2O12.C22H42N2O9.C16H31NO6.C15H30O4.2C8H17NO3.3CH4.6W/c1-3-10-36-14-18-40-22-26(32)7-5-12-38-16-21-43-25-29(35)31-9-13-39-17-19-41-23-27(33)8-6-11-37-15-20-42-24-28(34)30-4-2;1-3-8-28-11-15-33-19-22(27)24-7-10-30-13-14-31-17-20(25)6-5-9-29-12-16-32-18-21(26)23-4-2;1-3-7-20-9-11-22-13-15(18)6-5-8-21-10-12-23-14-16(19)17-4-2;1-3-5-9-17-11-13-19-14-12-18-10-7-6-8-15(16)4-2;2*1-3-4-11-5-6-12-7-8(10)9-2;;;;;;;;;/h3-25H2,1-2H3,(H,30,34)(H,31,35);3-19H2,1-2H3,(H,23,26)(H,24,27);3-14H2,1-2H3,(H,17,19);3-14H2,1-2H3;2*3-7H2,1-2H3,(H,9,10);3*1H4;;;;;;
InChIKeyMDQFHISLVUBFSR-UHFFFAOYSA-N
XLogP6.76
TPSA519.80 Ų
H-Bond Donors7
H-Bond Acceptors37
Rotatable Bonds105
Heavy Atoms151
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003210.79
LogP ≤ 56.76
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

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

Analyze 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten with MolForge

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Related Compounds

N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide
CID 157294049
N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide
CID 89101434
decan-3-one;N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]propanamide;6-(2-propoxyethoxy)hexan-3-one;tridecan-3-one;undecane;undecan-3-one
CID 163571556
N-[2-[2-(2,8-dioxodecoxy)ethoxy]ethyl]propanamide
CID 58079400
2-[2-[2-[5-[[2-(2-butoxyethoxy)acetyl]amino]pentoxy]ethoxy]ethoxy]-N-methylacetamide
CID 134582817
6-oxo-N-[2-[2-[2-oxo-5-[2-(2-oxopropoxy)ethoxy]pentoxy]ethoxy]ethyl]octanamide
CID 58143549
N-[2-[2-[2-(ethylamino)-2-oxoethoxy]ethoxy]ethyl]octadecanamide
CID 89136762
N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
CID 89176591
N-(6-oxooctyl)-4-propoxybutanamide
CID 170362710
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide;ethane;methane
CID 178085327
2-[2-(4-oxoheptoxy)ethoxy]-N-[2-[2-(2-oxopropoxy)ethoxy]ethyl]acetamide
CID 58214492
2-(2-butoxyethoxy)-N-(2-hydroxyethyl)acetamide
CID 89471630

Frequently Asked Questions

What is the IUPAC name of 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten?
The IUPAC name of 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten (CID 159536331) is 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten.
What is the SMILES notation for 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten?
The canonical SMILES for 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten is C.C.C.CCCCOCCOCCOCCCCC(=O)CC.CCCOCCOCC(=O)CCCOCCOCC(=O)NCC.CCCOCCOCC(=O)CCCOCCOCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)NCC.CCCOCCOCC(=O)NC.CCCOCCOCC(=O)NC.CCCOCCOCC(=O)NCCOCCOCC(=O)CCCOCCOCC(=O)NCC.[W].[W].[W].[W].[W].[W].
What is the InChIKey of 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten?
The InChIKey is MDQFHISLVUBFSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H54N2O12.C22H42N2O9.C16H31NO6.C15H30O4.2C8H17NO3.3CH4.6W/c1-3-10-36-14-18-40-22-26(32)7-5-12-38-16-21-43-25-29(35)31-9-13-39-17-19-41-23-27(33)8-6-11-37-15-20-42-24-28(34)30-4-2;1-3-8-28-11-15-33-19-22(27)24-7-10-30-13-14-31-17-20(25)6-5-9-29-12-16-32-18-21(26)23-4-2;1-3-7-20-9-11-22-13-15(18)6-5-8-21-10-12-23-14-16(19)17-4-2;1-3-5-9-17-11-13-19-14-12-18-10-7-6-8-15(16)4-2;2*1-3-4-11-5-6-12-7-8(10)9-2;;;;;;;;;/h3-25H2,1-2H3,(H,30,34)(H,31,35);3-19H2,1-2H3,(H,23,26)(H,24,27);3-14H2,1-2H3,(H,17,19);3-14H2,1-2H3;2*3-7H2,1-2H3,(H,9,10);3*1H4;;;;;;.
What are the key properties of 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten?
7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten has a molecular weight of 3210.79 g/mol, XLogP of 6.76, 105 rotatable bonds, 7 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(2-butoxyethoxy)ethoxy]heptan-3-one;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]pentoxy]ethoxy]acetamide;N-ethyl-2-[2-[4-oxo-5-(2-propoxyethoxy)pentoxy]ethoxy]acetamide;methane;bis(N-methyl-2-(2-propoxyethoxy)acetamide);tungsten is sourced from PubChem (CID 159536331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).