1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone

C11H22N2O2 — CID 60841287

IUPAC1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone
SMILESCC(C)NCC(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C11H22N2O2/c1-9(2)12-7-10(14)13-5-6-15-11(3,4)8-13/h9,12H,5-8H2,1-4H3
InChIKeyWVUAJBLLFLCGLC-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.62
Rot. Bonds3

About 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone

1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone (PubChem CID 60841287) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone.

Molecular Properties

Compound Name1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone
PubChem CID60841287
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone
SMILESCC(C)NCC(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C11H22N2O2/c1-9(2)12-7-10(14)13-5-6-15-11(3,4)8-13/h9,12H,5-8H2,1-4H3
InChIKeyWVUAJBLLFLCGLC-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone?
The IUPAC name of 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone (CID 60841287) is 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone.
What is the SMILES notation for 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone?
The canonical SMILES for 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone is CC(C)NCC(=O)N1CCOC(C)(C)C1.
What is the InChIKey of 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone?
The InChIKey is WVUAJBLLFLCGLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2)12-7-10(14)13-5-6-15-11(3,4)8-13/h9,12H,5-8H2,1-4H3.
What are the key properties of 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone?
1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone has a molecular weight of 214.31 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylmorpholin-4-yl)-2-(propan-2-ylamino)ethanone is sourced from PubChem (CID 60841287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).