2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide

C13H27N3O2 — CID 102938763

IUPAC2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)N1CC(C)OC(CN)C1
InChIInChI=1S/C13H27N3O2/c1-5-15(6-2)13(17)11(4)16-8-10(3)18-12(7-14)9-16/h10-12H,5-9,14H2,1-4H3
InChIKeyYSNZFAZYZBGXFA-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.29
Rot. Bonds5

About 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide

2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide (PubChem CID 102938763) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide
PubChem CID102938763
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC Name2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)N1CC(C)OC(CN)C1
InChIInChI=1S/C13H27N3O2/c1-5-15(6-2)13(17)11(4)16-8-10(3)18-12(7-14)9-16/h10-12H,5-9,14H2,1-4H3
InChIKeyYSNZFAZYZBGXFA-UHFFFAOYSA-N
XLogP0.29
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(2-methylbutan-2-yl)propanamide
CID 102938963
2-[3-(aminomethyl)piperidin-1-yl]-N,N-diethylpropanamide
CID 55210780
2-(3,5-dimethylpiperazin-1-yl)-N,N-diethylpropanamide
CID 63874454
N-ethyl-2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]propanamide
CID 102935684
2-[4-(aminomethyl)-2-methylpyrrolidin-1-yl]-N,N-diethylpropanamide
CID 113319950
2-(4-amino-3-methylpiperidin-1-yl)-N,N-diethylpropanamide
CID 79867648
N,N-diethyl-2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]propanamide
CID 114779602
2-[3-(2-aminoethyl)piperidin-1-yl]-N,N-diethylpropanamide;hydrochloride
CID 120728523
2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 60644884
2-[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-N,N-diethylpropanamide;hydrochloride
CID 120758550
methyl 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoate
CID 103936716
N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide
CID 114500324

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide?
The IUPAC name of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide (CID 102938763) is 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide.
What is the SMILES notation for 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide?
The canonical SMILES for 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)N1CC(C)OC(CN)C1.
What is the InChIKey of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide?
The InChIKey is YSNZFAZYZBGXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-5-15(6-2)13(17)11(4)16-8-10(3)18-12(7-14)9-16/h10-12H,5-9,14H2,1-4H3.
What are the key properties of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide?
2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide has a molecular weight of 257.38 g/mol, XLogP of 0.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide is sourced from PubChem (CID 102938763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).