N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide

C10H19N3O4 — CID 102936068

IUPACN'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide
SMILESCC(=O)NNC(=O)CN1CC(C)OC(CO)C1
InChIInChI=1S/C10H19N3O4/c1-7-3-13(4-9(6-14)17-7)5-10(16)12-11-8(2)15/h7,9,14H,3-6H2,1-2H3,(H,11,15)(H,12,16)
InChIKeyXLQVGZWRXSABQE-UHFFFAOYSA-N
MW245.28 g/mol
LogP-1.76
Rot. Bonds3

About N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide

N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide (PubChem CID 102936068) has the molecular formula C10H19N3O4 and a molecular weight of 245.28 g/mol. Its IUPAC name is N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide.

Molecular Properties

Compound NameN'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide
PubChem CID102936068
Molecular FormulaC10H19N3O4
Molecular Weight245.28 g/mol
Exact Mass245.14
IUPAC NameN'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide
SMILESCC(=O)NNC(=O)CN1CC(C)OC(CO)C1
InChIInChI=1S/C10H19N3O4/c1-7-3-13(4-9(6-14)17-7)5-10(16)12-11-8(2)15/h7,9,14H,3-6H2,1-2H3,(H,11,15)(H,12,16)
InChIKeyXLQVGZWRXSABQE-UHFFFAOYSA-N
XLogP-1.76
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 5-1.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide?
The IUPAC name of N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide (CID 102936068) is N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide.
What is the SMILES notation for N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide?
The canonical SMILES for N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide is CC(=O)NNC(=O)CN1CC(C)OC(CO)C1.
What is the InChIKey of N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide?
The InChIKey is XLQVGZWRXSABQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O4/c1-7-3-13(4-9(6-14)17-7)5-10(16)12-11-8(2)15/h7,9,14H,3-6H2,1-2H3,(H,11,15)(H,12,16).
What are the key properties of N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide?
N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide has a molecular weight of 245.28 g/mol, XLogP of -1.76, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide is sourced from PubChem (CID 102936068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).