N-(1,2,2-triacetamidoethyl)acetamide

C10H18N4O4 — CID 15847201

IUPACN-(1,2,2-triacetamidoethyl)acetamide
SMILESCC(=O)NC(NC(C)=O)C(NC(C)=O)NC(C)=O
InChIInChI=1S/C10H18N4O4/c1-5(15)11-9(12-6(2)16)10(13-7(3)17)14-8(4)18/h9-10H,1-4H3,(H,11,15)(H,12,16)(H,13,17)(H,14,18)
InChIKeyAIQUGDZDLLSVKC-UHFFFAOYSA-N
MW258.28 g/mol
LogP-1.82
Rot. Bonds5

About N-(1,2,2-triacetamidoethyl)acetamide

N-(1,2,2-triacetamidoethyl)acetamide (PubChem CID 15847201) has the molecular formula C10H18N4O4 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-(1,2,2-triacetamidoethyl)acetamide.

Molecular Properties

Compound NameN-(1,2,2-triacetamidoethyl)acetamide
PubChem CID15847201
Molecular FormulaC10H18N4O4
Molecular Weight258.28 g/mol
Exact Mass258.13
IUPAC NameN-(1,2,2-triacetamidoethyl)acetamide
SMILESCC(=O)NC(NC(C)=O)C(NC(C)=O)NC(C)=O
InChIInChI=1S/C10H18N4O4/c1-5(15)11-9(12-6(2)16)10(13-7(3)17)14-8(4)18/h9-10H,1-4H3,(H,11,15)(H,12,16)(H,13,17)(H,14,18)
InChIKeyAIQUGDZDLLSVKC-UHFFFAOYSA-N
XLogP-1.82
TPSA116.40 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 5-1.82
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1,2,2-triacetamidoethyl)acetamide?
The IUPAC name of N-(1,2,2-triacetamidoethyl)acetamide (CID 15847201) is N-(1,2,2-triacetamidoethyl)acetamide.
What is the SMILES notation for N-(1,2,2-triacetamidoethyl)acetamide?
The canonical SMILES for N-(1,2,2-triacetamidoethyl)acetamide is CC(=O)NC(NC(C)=O)C(NC(C)=O)NC(C)=O.
What is the InChIKey of N-(1,2,2-triacetamidoethyl)acetamide?
The InChIKey is AIQUGDZDLLSVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O4/c1-5(15)11-9(12-6(2)16)10(13-7(3)17)14-8(4)18/h9-10H,1-4H3,(H,11,15)(H,12,16)(H,13,17)(H,14,18).
What are the key properties of N-(1,2,2-triacetamidoethyl)acetamide?
N-(1,2,2-triacetamidoethyl)acetamide has a molecular weight of 258.28 g/mol, XLogP of -1.82, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,2-triacetamidoethyl)acetamide is sourced from PubChem (CID 15847201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).