N,N'-bis(3-ethoxypropyl)oxamide

C12H24N2O4 — CID 3127284

IUPACN,N'-bis(3-ethoxypropyl)oxamide
SMILESCCOCCCNC(=O)C(=O)NCCCOCC
InChIInChI=1S/C12H24N2O4/c1-3-17-9-5-7-13-11(15)12(16)14-8-6-10-18-4-2/h3-10H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyBSRSWXFSDRFWCJ-UHFFFAOYSA-N
MW260.33 g/mol
LogP0.07
Rot. Bonds10

About N,N'-bis(3-ethoxypropyl)oxamide

N,N'-bis(3-ethoxypropyl)oxamide (PubChem CID 3127284) has the molecular formula C12H24N2O4 and a molecular weight of 260.33 g/mol. Its IUPAC name is N,N'-bis(3-ethoxypropyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(3-ethoxypropyl)oxamide
PubChem CID3127284
Molecular FormulaC12H24N2O4
Molecular Weight260.33 g/mol
Exact Mass260.17
IUPAC NameN,N'-bis(3-ethoxypropyl)oxamide
SMILESCCOCCCNC(=O)C(=O)NCCCOCC
InChIInChI=1S/C12H24N2O4/c1-3-17-9-5-7-13-11(15)12(16)14-8-6-10-18-4-2/h3-10H2,1-2H3,(H,13,15)(H,14,16)
InChIKeyBSRSWXFSDRFWCJ-UHFFFAOYSA-N
XLogP0.07
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.33
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(3-ethoxypropyl)oxamide?
The IUPAC name of N,N'-bis(3-ethoxypropyl)oxamide (CID 3127284) is N,N'-bis(3-ethoxypropyl)oxamide.
What is the SMILES notation for N,N'-bis(3-ethoxypropyl)oxamide?
The canonical SMILES for N,N'-bis(3-ethoxypropyl)oxamide is CCOCCCNC(=O)C(=O)NCCCOCC.
What is the InChIKey of N,N'-bis(3-ethoxypropyl)oxamide?
The InChIKey is BSRSWXFSDRFWCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O4/c1-3-17-9-5-7-13-11(15)12(16)14-8-6-10-18-4-2/h3-10H2,1-2H3,(H,13,15)(H,14,16).
What are the key properties of N,N'-bis(3-ethoxypropyl)oxamide?
N,N'-bis(3-ethoxypropyl)oxamide has a molecular weight of 260.33 g/mol, XLogP of 0.07, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(3-ethoxypropyl)oxamide is sourced from PubChem (CID 3127284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).