2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide

C12H25N3O2 — CID 102746297

IUPAC2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide
SMILESCC(CN1CC(C)(C)OC(C)(C)C1)C(=O)NN
InChIInChI=1S/C12H25N3O2/c1-9(10(16)14-13)6-15-7-11(2,3)17-12(4,5)8-15/h9H,6-8,13H2,1-5H3,(H,14,16)
InChIKeySHJCZNMSPVCBKE-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.50
Rot. Bonds3

About 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide

2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide (PubChem CID 102746297) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide.

Molecular Properties

Compound Name2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide
PubChem CID102746297
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide
SMILESCC(CN1CC(C)(C)OC(C)(C)C1)C(=O)NN
InChIInChI=1S/C12H25N3O2/c1-9(10(16)14-13)6-15-7-11(2,3)17-12(4,5)8-15/h9H,6-8,13H2,1-5H3,(H,14,16)
InChIKeySHJCZNMSPVCBKE-UHFFFAOYSA-N
XLogP0.50
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

methyl 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanoate
CID 102744546
3-(azetidin-1-yl)-2-methylpropanehydrazide
CID 130548534
3-(3,3-difluoropyrrolidin-1-yl)-2-methylpropanehydrazide
CID 130632039
2-(propylamino)-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanamide
CID 102745496
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropanehydrazide
CID 104961276
3-[4-(hydroxymethyl)piperidin-1-yl]-2-methylpropanehydrazide
CID 63570764
2,2,6,6-tetramethylmorpholine-4-carbohydrazide
CID 102745077
3-methyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)pentan-2-amine
CID 102743395
3,3-dimethyl-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-2-ol
CID 102745364
3-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-2-methylpropanehydrazide
CID 114801954
3-(4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-2-methylpropanehydrazide
CID 81115710
1-cyclopropyl-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanol
CID 102745370

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide?
The IUPAC name of 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide (CID 102746297) is 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide.
What is the SMILES notation for 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide?
The canonical SMILES for 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide is CC(CN1CC(C)(C)OC(C)(C)C1)C(=O)NN.
What is the InChIKey of 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide?
The InChIKey is SHJCZNMSPVCBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-9(10(16)14-13)6-15-7-11(2,3)17-12(4,5)8-15/h9H,6-8,13H2,1-5H3,(H,14,16).
What are the key properties of 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide?
2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide has a molecular weight of 243.35 g/mol, XLogP of 0.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propanehydrazide is sourced from PubChem (CID 102746297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).