2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide

C13H25N3O3 — CID 102938880

IUPAC2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide
SMILESCC1CN(CC(=O)NC2CCOCC2)CC(CN)O1
InChIInChI=1S/C13H25N3O3/c1-10-7-16(8-12(6-14)19-10)9-13(17)15-11-2-4-18-5-3-11/h10-12H,2-9,14H2,1H3,(H,15,17)
InChIKeyDSYOVXUGTUMSHK-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.67
Rot. Bonds4

About 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide

2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide (PubChem CID 102938880) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide
PubChem CID102938880
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide
SMILESCC1CN(CC(=O)NC2CCOCC2)CC(CN)O1
InChIInChI=1S/C13H25N3O3/c1-10-7-16(8-12(6-14)19-10)9-13(17)15-11-2-4-18-5-3-11/h10-12H,2-9,14H2,1H3,(H,15,17)
InChIKeyDSYOVXUGTUMSHK-UHFFFAOYSA-N
XLogP-0.67
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-cyclopropylacetamide
CID 102938931
2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(2-methylbutan-2-yl)acetamide
CID 102938967
2-(3-aminoazetidin-1-yl)-N-(oxan-4-yl)acetamide
CID 63760722
2-(3-amino-4-methylpyrrolidin-1-yl)-N-(oxan-4-yl)acetamide
CID 103576576
N-cyclooctyl-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]acetamide
CID 2446989
2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide
CID 62548940
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-N-(oxan-4-yl)acetamide
CID 114779721
N-(cyclopropylcarbamoyl)-2-(2,6-dimethylmorpholin-4-yl)acetamide
CID 17421099
2-[3-(methylamino)piperidin-1-yl]-N-(oxan-4-yl)acetamide;hydrochloride
CID 119920439
2-(3-hydroxypiperidin-1-yl)-N-(oxan-4-yl)acetamide
CID 63097682
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(oxan-4-yl)acetamide
CID 63099068
N-cyclopropyl-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]acetamide
CID 27444185

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide?
The IUPAC name of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide (CID 102938880) is 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide?
The canonical SMILES for 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide is CC1CN(CC(=O)NC2CCOCC2)CC(CN)O1.
What is the InChIKey of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide?
The InChIKey is DSYOVXUGTUMSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-10-7-16(8-12(6-14)19-10)9-13(17)15-11-2-4-18-5-3-11/h10-12H,2-9,14H2,1H3,(H,15,17).
What are the key properties of 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide?
2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide has a molecular weight of 271.36 g/mol, XLogP of -0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N-(oxan-4-yl)acetamide is sourced from PubChem (CID 102938880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).