N,N'-bis(3-propan-2-yloxypropyl)oxamide

C14H28N2O4 — CID 3126765

IUPACN,N'-bis(3-propan-2-yloxypropyl)oxamide
SMILESCC(C)OCCCNC(=O)C(=O)NCCCOC(C)C
InChIInChI=1S/C14H28N2O4/c1-11(2)19-9-5-7-15-13(17)14(18)16-8-6-10-20-12(3)4/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyHVZKKUGBZNJNFL-UHFFFAOYSA-N
MW288.39 g/mol
LogP0.85
Rot. Bonds10

About N,N'-bis(3-propan-2-yloxypropyl)oxamide

N,N'-bis(3-propan-2-yloxypropyl)oxamide (PubChem CID 3126765) has the molecular formula C14H28N2O4 and a molecular weight of 288.39 g/mol. Its IUPAC name is N,N'-bis(3-propan-2-yloxypropyl)oxamide.

Molecular Properties

Compound NameN,N'-bis(3-propan-2-yloxypropyl)oxamide
PubChem CID3126765
Molecular FormulaC14H28N2O4
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN,N'-bis(3-propan-2-yloxypropyl)oxamide
SMILESCC(C)OCCCNC(=O)C(=O)NCCCOC(C)C
InChIInChI=1S/C14H28N2O4/c1-11(2)19-9-5-7-15-13(17)14(18)16-8-6-10-20-12(3)4/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18)
InChIKeyHVZKKUGBZNJNFL-UHFFFAOYSA-N
XLogP0.85
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 50.85
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-propan-2-yloxypropyl)oxamide?
The IUPAC name of N,N'-bis(3-propan-2-yloxypropyl)oxamide (CID 3126765) is N,N'-bis(3-propan-2-yloxypropyl)oxamide.
What is the SMILES notation for N,N'-bis(3-propan-2-yloxypropyl)oxamide?
The canonical SMILES for N,N'-bis(3-propan-2-yloxypropyl)oxamide is CC(C)OCCCNC(=O)C(=O)NCCCOC(C)C.
What is the InChIKey of N,N'-bis(3-propan-2-yloxypropyl)oxamide?
The InChIKey is HVZKKUGBZNJNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O4/c1-11(2)19-9-5-7-15-13(17)14(18)16-8-6-10-20-12(3)4/h11-12H,5-10H2,1-4H3,(H,15,17)(H,16,18).
What are the key properties of N,N'-bis(3-propan-2-yloxypropyl)oxamide?
N,N'-bis(3-propan-2-yloxypropyl)oxamide has a molecular weight of 288.39 g/mol, XLogP of 0.85, 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-propan-2-yloxypropyl)oxamide is sourced from PubChem (CID 3126765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).