2-(1,4-dioxan-2-ylmethylamino)acetamide

C7H14N2O3 — CID 60975566

IUPAC2-(1,4-dioxan-2-ylmethylamino)acetamide
SMILESNC(=O)CNCC1COCCO1
InChIInChI=1S/C7H14N2O3/c8-7(10)4-9-3-6-5-11-1-2-12-6/h6,9H,1-5H2,(H2,8,10)
InChIKeyUDHNUXGQAKJWLN-UHFFFAOYSA-N
MW174.20 g/mol
LogP-1.52
Rot. Bonds4

About 2-(1,4-dioxan-2-ylmethylamino)acetamide

2-(1,4-dioxan-2-ylmethylamino)acetamide (PubChem CID 60975566) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-(1,4-dioxan-2-ylmethylamino)acetamide.

Molecular Properties

Compound Name2-(1,4-dioxan-2-ylmethylamino)acetamide
PubChem CID60975566
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name2-(1,4-dioxan-2-ylmethylamino)acetamide
SMILESNC(=O)CNCC1COCCO1
InChIInChI=1S/C7H14N2O3/c8-7(10)4-9-3-6-5-11-1-2-12-6/h6,9H,1-5H2,(H2,8,10)
InChIKeyUDHNUXGQAKJWLN-UHFFFAOYSA-N
XLogP-1.52
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-1.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dioxan-2-ylmethylamino)acetamide?
The IUPAC name of 2-(1,4-dioxan-2-ylmethylamino)acetamide (CID 60975566) is 2-(1,4-dioxan-2-ylmethylamino)acetamide.
What is the SMILES notation for 2-(1,4-dioxan-2-ylmethylamino)acetamide?
The canonical SMILES for 2-(1,4-dioxan-2-ylmethylamino)acetamide is NC(=O)CNCC1COCCO1.
What is the InChIKey of 2-(1,4-dioxan-2-ylmethylamino)acetamide?
The InChIKey is UDHNUXGQAKJWLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3/c8-7(10)4-9-3-6-5-11-1-2-12-6/h6,9H,1-5H2,(H2,8,10).
What are the key properties of 2-(1,4-dioxan-2-ylmethylamino)acetamide?
2-(1,4-dioxan-2-ylmethylamino)acetamide has a molecular weight of 174.20 g/mol, XLogP of -1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dioxan-2-ylmethylamino)acetamide is sourced from PubChem (CID 60975566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).