4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide

C11H23N3O2 — CID 63053164

IUPAC4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide
SMILESCNC(CCN1CCOC(C)(C)C1)C(N)=O
InChIInChI=1S/C11H23N3O2/c1-11(2)8-14(6-7-16-11)5-4-9(13-3)10(12)15/h9,13H,4-8H2,1-3H3,(H2,12,15)
InChIKeyVHPTZVCQQFOLGF-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.44
Rot. Bonds5

About 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide

4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide (PubChem CID 63053164) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide.

Molecular Properties

Compound Name4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide
PubChem CID63053164
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide
SMILESCNC(CCN1CCOC(C)(C)C1)C(N)=O
InChIInChI=1S/C11H23N3O2/c1-11(2)8-14(6-7-16-11)5-4-9(13-3)10(12)15/h9,13H,4-8H2,1-3H3,(H2,12,15)
InChIKeyVHPTZVCQQFOLGF-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide?
The IUPAC name of 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide (CID 63053164) is 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide.
What is the SMILES notation for 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide?
The canonical SMILES for 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide is CNC(CCN1CCOC(C)(C)C1)C(N)=O.
What is the InChIKey of 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide?
The InChIKey is VHPTZVCQQFOLGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-11(2)8-14(6-7-16-11)5-4-9(13-3)10(12)15/h9,13H,4-8H2,1-3H3,(H2,12,15).
What are the key properties of 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide?
4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide has a molecular weight of 229.32 g/mol, XLogP of -0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylmorpholin-4-yl)-2-(methylamino)butanamide is sourced from PubChem (CID 63053164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).