N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide

C14H28N2O6 — CID 54093203

IUPACN,N,N',N'-tetrakis(2-hydroxypropyl)oxamide
SMILESCC(O)CN(CC(C)O)C(=O)C(=O)N(CC(C)O)CC(C)O
InChIInChI=1S/C14H28N2O6/c1-9(17)5-15(6-10(2)18)13(21)14(22)16(7-11(3)19)8-12(4)20/h9-12,17-20H,5-8H2,1-4H3
InChIKeyMVHRZQPHASWUSL-UHFFFAOYSA-N
MW320.39 g/mol
LogP-1.83
Rot. Bonds8

About N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide

N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide (PubChem CID 54093203) has the molecular formula C14H28N2O6 and a molecular weight of 320.39 g/mol. Its IUPAC name is N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide.

Molecular Properties

Compound NameN,N,N',N'-tetrakis(2-hydroxypropyl)oxamide
PubChem CID54093203
Molecular FormulaC14H28N2O6
Molecular Weight320.39 g/mol
Exact Mass320.19
IUPAC NameN,N,N',N'-tetrakis(2-hydroxypropyl)oxamide
SMILESCC(O)CN(CC(C)O)C(=O)C(=O)N(CC(C)O)CC(C)O
InChIInChI=1S/C14H28N2O6/c1-9(17)5-15(6-10(2)18)13(21)14(22)16(7-11(3)19)8-12(4)20/h9-12,17-20H,5-8H2,1-4H3
InChIKeyMVHRZQPHASWUSL-UHFFFAOYSA-N
XLogP-1.83
TPSA121.54 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 5-1.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide?
The IUPAC name of N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide (CID 54093203) is N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide.
What is the SMILES notation for N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide?
The canonical SMILES for N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide is CC(O)CN(CC(C)O)C(=O)C(=O)N(CC(C)O)CC(C)O.
What is the InChIKey of N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide?
The InChIKey is MVHRZQPHASWUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O6/c1-9(17)5-15(6-10(2)18)13(21)14(22)16(7-11(3)19)8-12(4)20/h9-12,17-20H,5-8H2,1-4H3.
What are the key properties of N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide?
N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide has a molecular weight of 320.39 g/mol, XLogP of -1.83, 8 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N',N'-tetrakis(2-hydroxypropyl)oxamide is sourced from PubChem (CID 54093203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).