2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide

C9H18N2O3 — CID 114779554

IUPAC2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide
SMILESCC1(C)CN(CC(N)=O)CC(CO)O1
InChIInChI=1S/C9H18N2O3/c1-9(2)6-11(4-8(10)13)3-7(5-12)14-9/h7,12H,3-6H2,1-2H3,(H2,10,13)
InChIKeyMGAGOTLSUVJJJT-UHFFFAOYSA-N
MW202.25 g/mol
LogP-1.06
Rot. Bonds3

About 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide

2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide (PubChem CID 114779554) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide.

Molecular Properties

Compound Name2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide
PubChem CID114779554
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide
SMILESCC1(C)CN(CC(N)=O)CC(CO)O1
InChIInChI=1S/C9H18N2O3/c1-9(2)6-11(4-8(10)13)3-7(5-12)14-9/h7,12H,3-6H2,1-2H3,(H2,10,13)
InChIKeyMGAGOTLSUVJJJT-UHFFFAOYSA-N
XLogP-1.06
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide?
The IUPAC name of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide (CID 114779554) is 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide.
What is the SMILES notation for 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide?
The canonical SMILES for 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide is CC1(C)CN(CC(N)=O)CC(CO)O1.
What is the InChIKey of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide?
The InChIKey is MGAGOTLSUVJJJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-9(2)6-11(4-8(10)13)3-7(5-12)14-9/h7,12H,3-6H2,1-2H3,(H2,10,13).
What are the key properties of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide?
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide has a molecular weight of 202.25 g/mol, XLogP of -1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide is sourced from PubChem (CID 114779554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).