N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide

C17H34N2O6 — CID 89176591

IUPACN-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
SMILESCCCCNC(=O)COCCOCCNC(=O)COCCOCCC
InChIInChI=1S/C17H34N2O6/c1-3-5-6-18-16(20)14-25-13-11-23-9-7-19-17(21)15-24-12-10-22-8-4-2/h3-15H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyRPQKUORRGPYWFG-UHFFFAOYSA-N
MW362.47 g/mol
LogP0.50
Rot. Bonds18

About N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide

N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide (PubChem CID 89176591) has the molecular formula C17H34N2O6 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide.

Molecular Properties

Compound NameN-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
PubChem CID89176591
Molecular FormulaC17H34N2O6
Molecular Weight362.47 g/mol
Exact Mass362.24
IUPAC NameN-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
SMILESCCCCNC(=O)COCCOCCNC(=O)COCCOCCC
InChIInChI=1S/C17H34N2O6/c1-3-5-6-18-16(20)14-25-13-11-23-9-7-19-17(21)15-24-12-10-22-8-4-2/h3-15H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyRPQKUORRGPYWFG-UHFFFAOYSA-N
XLogP0.50
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]butanamide
CID 89176712
2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide
CID 155190113
N-[2-[2-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxymethyl]propanamide
CID 137465988
N-[2-[2-[2-[2-[2-[2-(butylamino)-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethyl]heptanamide
CID 89417865
N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide
CID 89101434
2-(2-propoxyethoxy)-N-propylacetamide
CID 149463198
4-[[2-[2-(2-acetamidoethoxy)ethoxy]acetyl]amino]-N-butylbutanamide
CID 123251408
N-[2-[2-[2-(ethylamino)-2-oxoethoxy]ethoxy]ethyl]octadecanamide
CID 89136762
N-[2-(2-aminoethoxy)ethyl]-2-propoxyacetamide
CID 107941598
2-(2-oxopropoxy)-N-[2-(2-propoxyethoxy)ethyl]acetamide
CID 123445865
ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
CID 171823735
ethane;2-ethoxy-N-[2-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 142043663

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide?
The IUPAC name of N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide (CID 89176591) is N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide.
What is the SMILES notation for N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide?
The canonical SMILES for N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide is CCCCNC(=O)COCCOCCNC(=O)COCCOCCC.
What is the InChIKey of N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide?
The InChIKey is RPQKUORRGPYWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O6/c1-3-5-6-18-16(20)14-25-13-11-23-9-7-19-17(21)15-24-12-10-22-8-4-2/h3-15H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide?
N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide has a molecular weight of 362.47 g/mol, XLogP of 0.50, 18 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide is sourced from PubChem (CID 89176591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).