N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide

C25H46N6O10 — CID 170214750

IUPACN-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
SMILESCCCC(=O)NCCOCCOCCOCCOCCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC
InChIInChI=1S/C25H46N6O10/c1-3-5-20(32)27-7-9-39-11-13-41-15-14-40-12-10-38-8-6-21(33)28-17-23(35)30-19-25(37)31-18-24(36)29-16-22(34)26-4-2/h3-19H2,1-2H3,(H,26,34)(H,27,32)(H,28,33)(H,29,36)(H,30,35)(H,31,37)
InChIKeyNYPOWVHGFRWJAA-UHFFFAOYSA-N
MW590.68 g/mol
LogP-3.04
Rot. Bonds26

About N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide

N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide (PubChem CID 170214750) has the molecular formula C25H46N6O10 and a molecular weight of 590.68 g/mol. Its IUPAC name is N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide.

Molecular Properties

Compound NameN-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
PubChem CID170214750
Molecular FormulaC25H46N6O10
Molecular Weight590.68 g/mol
Exact Mass590.33
IUPAC NameN-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
SMILESCCCC(=O)NCCOCCOCCOCCOCCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC
InChIInChI=1S/C25H46N6O10/c1-3-5-20(32)27-7-9-39-11-13-41-15-14-40-12-10-38-8-6-21(33)28-17-23(35)30-19-25(37)31-18-24(36)29-16-22(34)26-4-2/h3-19H2,1-2H3,(H,26,34)(H,27,32)(H,28,33)(H,29,36)(H,30,35)(H,31,37)
InChIKeyNYPOWVHGFRWJAA-UHFFFAOYSA-N
XLogP-3.04
TPSA211.52 Ų
H-Bond Donors6
H-Bond Acceptors10
Rotatable Bonds26
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500590.68
LogP ≤ 5-3.04
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide with MolForge

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Related Compounds

N-[2-(2-propoxyethoxy)ethyl]butanamide
CID 88853938
N-ethyl-3-[2-(2-propoxyethoxy)ethoxy]propanamide
CID 144855445
3-[2-[2-[2-(butanoylamino)ethoxy]ethoxy]ethoxy]propanoic acid
CID 175775195
N-[2-[2-[3-(2-aminoethoxy)propanoylamino]ethoxy]ethyl]butanamide
CID 168852472
3-(2-propoxyethoxy)-N-propylpropanamide
CID 163586322
ethane;N-[2-[2-[3-oxo-3-(propan-2-ylamino)propoxy]ethoxy]ethyl]butanamide
CID 166081207
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen
CID 176987409
N-[2-[2-[2-[2-(4,4-dimethyl-3-oxopentoxy)ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 158125954
2-[[2-(3-propoxypropanoylamino)acetyl]amino]acetic acid
CID 62686785
N-ethyl-3-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 164717500
ethane;3-propoxy-N-propylpropanamide
CID 163269237
N-[2-[2-[2-[2-[2-(butanoylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-methylbutanamide
CID 129177572

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide?
The IUPAC name of N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide (CID 170214750) is N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide.
What is the SMILES notation for N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide?
The canonical SMILES for N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide is CCCC(=O)NCCOCCOCCOCCOCCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)NCC.
What is the InChIKey of N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide?
The InChIKey is NYPOWVHGFRWJAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H46N6O10/c1-3-5-20(32)27-7-9-39-11-13-41-15-14-40-12-10-38-8-6-21(33)28-17-23(35)30-19-25(37)31-18-24(36)29-16-22(34)26-4-2/h3-19H2,1-2H3,(H,26,34)(H,27,32)(H,28,33)(H,29,36)(H,30,35)(H,31,37).
What are the key properties of N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide?
N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide has a molecular weight of 590.68 g/mol, XLogP of -3.04, 26 rotatable bonds, 6 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[2-[3-[[2-[[2-[[2-[[2-(ethylamino)-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide is sourced from PubChem (CID 170214750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).