3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide

C12H25N3O2 — CID 79408801

IUPAC3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide
SMILESCCC1COC(C)CN1C(C)C(C)C(=O)NN
InChIInChI=1S/C12H25N3O2/c1-5-11-7-17-8(2)6-15(11)10(4)9(3)12(16)14-13/h8-11H,5-7,13H2,1-4H3,(H,14,16)
InChIKeyQINKJBNKPHTTEI-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.50
Rot. Bonds4

About 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide

3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide (PubChem CID 79408801) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide.

Molecular Properties

Compound Name3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide
PubChem CID79408801
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide
SMILESCCC1COC(C)CN1C(C)C(C)C(=O)NN
InChIInChI=1S/C12H25N3O2/c1-5-11-7-17-8(2)6-15(11)10(4)9(3)12(16)14-13/h8-11H,5-7,13H2,1-4H3,(H,14,16)
InChIKeyQINKJBNKPHTTEI-UHFFFAOYSA-N
XLogP0.50
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
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'}

Analyze 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-ethyl-2-methylmorpholin-4-yl)butanehydrazide
CID 63578551
3-(5-ethyl-2-methylmorpholin-4-yl)-N,2-dimethylbutan-1-amine
CID 79409058
4-(5-ethyl-2-methylmorpholin-4-yl)pentanoic acid
CID 62212916
3-amino-2-(5-ethyl-2-methylmorpholin-4-yl)propan-1-ol
CID 104710882
4-amino-N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butanamide
CID 66432044
N-tert-butyl-3-(5-ethyl-2-methylmorpholin-4-yl)butan-1-amine
CID 62462303
3-amino-1-(5-ethyl-2-methylmorpholin-4-yl)butan-1-one;hydrochloride
CID 119682269
3-(2-ethylmorpholin-4-yl)-2-methylbutanehydrazide
CID 79408999
3-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-amine
CID 43575822
2-(5-ethyl-2-methylmorpholin-4-yl)-1-(4-methylphenyl)propan-1-one
CID 60680544
2-(5-ethyl-2-methylmorpholin-4-yl)-4-methylsulfanylbutan-1-amine
CID 61424177
2-amino-1-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-one
CID 43650344

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide?
The IUPAC name of 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide (CID 79408801) is 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide.
What is the SMILES notation for 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide?
The canonical SMILES for 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide is CCC1COC(C)CN1C(C)C(C)C(=O)NN.
What is the InChIKey of 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide?
The InChIKey is QINKJBNKPHTTEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-5-11-7-17-8(2)6-15(11)10(4)9(3)12(16)14-13/h8-11H,5-7,13H2,1-4H3,(H,14,16).
What are the key properties of 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide?
3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide has a molecular weight of 243.35 g/mol, XLogP of 0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyl-2-methylmorpholin-4-yl)-2-methylbutanehydrazide is sourced from PubChem (CID 79408801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).