N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide

C10H20N2O3 — CID 102935847

IUPACN-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CC(C)OC(CO)C1
InChIInChI=1S/C10H20N2O3/c1-8-5-12(4-3-11-9(2)14)6-10(7-13)15-8/h8,10,13H,3-7H2,1-2H3,(H,11,14)
InChIKeyKPSSEGKCIIVFRK-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.80
Rot. Bonds4

About N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide

N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide (PubChem CID 102935847) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide
PubChem CID102935847
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide
SMILESCC(=O)NCCN1CC(C)OC(CO)C1
InChIInChI=1S/C10H20N2O3/c1-8-5-12(4-3-11-9(2)14)6-10(7-13)15-8/h8,10,13H,3-7H2,1-2H3,(H,11,14)
InChIKeyKPSSEGKCIIVFRK-UHFFFAOYSA-N
XLogP-0.80
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide?
The IUPAC name of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide (CID 102935847) is N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide is CC(=O)NCCN1CC(C)OC(CO)C1.
What is the InChIKey of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide?
The InChIKey is KPSSEGKCIIVFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-8-5-12(4-3-11-9(2)14)6-10(7-13)15-8/h8,10,13H,3-7H2,1-2H3,(H,11,14).
What are the key properties of N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide?
N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide has a molecular weight of 216.28 g/mol, XLogP of -0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide is sourced from PubChem (CID 102935847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).