N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide

C14H28N2O3 — CID 114779602

IUPACN,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide
SMILESCCN(CC)C(=O)C(C)N1CC(CO)OC(C)(C)C1
InChIInChI=1S/C14H28N2O3/c1-6-15(7-2)13(18)11(3)16-8-12(9-17)19-14(4,5)10-16/h11-12,17H,6-10H2,1-5H3
InChIKeyAWVZBVYLVGBKIC-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.71
Rot. Bonds5

About N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide

N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide (PubChem CID 114779602) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide
PubChem CID114779602
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC NameN,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide
SMILESCCN(CC)C(=O)C(C)N1CC(CO)OC(C)(C)C1
InChIInChI=1S/C14H28N2O3/c1-6-15(7-2)13(18)11(3)16-8-12(9-17)19-14(4,5)10-16/h11-12,17H,6-10H2,1-5H3
InChIKeyAWVZBVYLVGBKIC-UHFFFAOYSA-N
XLogP0.71
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanoate
CID 114777322
(6,6-dimethyl-4-pentan-2-ylmorpholin-2-yl)methanol
CID 107886053
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanimidamide
CID 114777135
2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-N-propylpropanamide
CID 114782484
2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide
CID 102938763
[4-(3-amino-1,1,1-trifluorobutan-2-yl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776412
2-(3,5-dimethylpiperazin-1-yl)-N,N-diethylpropanamide
CID 63874454
6-(chloromethyl)-2,2-dimethyl-4-pentan-2-ylmorpholine
CID 107887624
N'-hydroxy-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]butanimidamide
CID 104969817
(6,6-dimethyl-4-methylsulfinylmorpholin-2-yl)methanol
CID 130877966
2-[6-(aminomethyl)-2,2-dimethylmorpholin-4-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 114782402
(2S)-2-amino-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-3-methylpentan-1-one
CID 104969811

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide?
The IUPAC name of N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide (CID 114779602) is N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide.
What is the SMILES notation for N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide?
The canonical SMILES for N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide is CCN(CC)C(=O)C(C)N1CC(CO)OC(C)(C)C1.
What is the InChIKey of N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide?
The InChIKey is AWVZBVYLVGBKIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-6-15(7-2)13(18)11(3)16-8-12(9-17)19-14(4,5)10-16/h11-12,17H,6-10H2,1-5H3.
What are the key properties of N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide?
N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide has a molecular weight of 272.39 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide is sourced from PubChem (CID 114779602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).