3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide

C9H19N3O3 — CID 102938189

IUPAC3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide
SMILESCC1CN(CCC(=O)NN)CC(CO)O1
InChIInChI=1S/C9H19N3O3/c1-7-4-12(3-2-9(14)11-10)5-8(6-13)15-7/h7-8,13H,2-6,10H2,1H3,(H,11,14)
InChIKeyTWBXGSMQOXZMOF-UHFFFAOYSA-N
MW217.27 g/mol
LogP-1.55
Rot. Bonds4

About 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide

3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide (PubChem CID 102938189) has the molecular formula C9H19N3O3 and a molecular weight of 217.27 g/mol. Its IUPAC name is 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide.

Molecular Properties

Compound Name3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide
PubChem CID102938189
Molecular FormulaC9H19N3O3
Molecular Weight217.27 g/mol
Exact Mass217.14
IUPAC Name3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide
SMILESCC1CN(CCC(=O)NN)CC(CO)O1
InChIInChI=1S/C9H19N3O3/c1-7-4-12(3-2-9(14)11-10)5-8(6-13)15-7/h7-8,13H,2-6,10H2,1H3,(H,11,14)
InChIKeyTWBXGSMQOXZMOF-UHFFFAOYSA-N
XLogP-1.55
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 5-1.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanamide
CID 102935428
N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide
CID 102935847
2-[2-[[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methyl]phenyl]acetohydrazide
CID 102938197
[(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol
CID 124842414
N'-acetyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]acetohydrazide
CID 102936068
[4-(2-azidoethyl)-6-methylmorpholin-2-yl]methanol
CID 102935371
(6-methyl-4-pent-3-ynylmorpholin-2-yl)methanol
CID 102935514
2-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethoxy]ethanol
CID 102934999
1-(2,6-dimethylmorpholin-4-yl)-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 102935864
2-[(2S,6R)-2-ethyl-6-methylmorpholin-4-yl]ethanol
CID 125154641
ethyl 3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanoate
CID 25113400
2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-N-(2-methoxyethyl)acetamide
CID 102935622

Frequently Asked Questions

What is the IUPAC name of 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide?
The IUPAC name of 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide (CID 102938189) is 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide.
What is the SMILES notation for 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide?
The canonical SMILES for 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide is CC1CN(CCC(=O)NN)CC(CO)O1.
What is the InChIKey of 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide?
The InChIKey is TWBXGSMQOXZMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O3/c1-7-4-12(3-2-9(14)11-10)5-8(6-13)15-7/h7-8,13H,2-6,10H2,1H3,(H,11,14).
What are the key properties of 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide?
3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide has a molecular weight of 217.27 g/mol, XLogP of -1.55, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanehydrazide is sourced from PubChem (CID 102938189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).