2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide

C9H19N3O2 — CID 104959272

IUPAC2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide
SMILESC[C@@H]1CN(CC(N)C(N)=O)C[C@H](C)O1
InChIInChI=1S/C9H19N3O2/c1-6-3-12(4-7(2)14-6)5-8(10)9(11)13/h6-8H,3-5,10H2,1-2H3,(H2,11,13)/t6-,7+,8?
InChIKeyWPXJYHZYQLQYFW-DHBOJHSNSA-N
MW201.27 g/mol
LogP-1.09
Rot. Bonds3

About 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide

2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide (PubChem CID 104959272) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide.

Molecular Properties

Compound Name2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide
PubChem CID104959272
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide
SMILESC[C@@H]1CN(CC(N)C(N)=O)C[C@H](C)O1
InChIInChI=1S/C9H19N3O2/c1-6-3-12(4-7(2)14-6)5-8(10)9(11)13/h6-8H,3-5,10H2,1-2H3,(H2,11,13)/t6-,7+,8?
InChIKeyWPXJYHZYQLQYFW-DHBOJHSNSA-N
XLogP-1.09
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-1.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-(2,6-dimethylmorpholin-4-yl)propan-1-ol
CID 64797367
1,3-bis(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 70522448
(2S)-1-(2,6-dimethylmorpholin-4-yl)-3-methylbutan-2-amine
CID 130522014
2-chloro-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propanoic acid
CID 104961253
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-methylpropanehydrazide
CID 104961276
ethyl 2-amino-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]butanoate
CID 104960242
2-amino-3-(3-methyl-4-oxopiperidin-1-yl)propanamide
CID 114501145
3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-(methylamino)propanoic acid
CID 104960300
2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 60644884
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-methoxypropan-2-amine
CID 104959190
1-bromo-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 104959987
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methoxybutan-2-amine
CID 104959201

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide?
The IUPAC name of 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide (CID 104959272) is 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide.
What is the SMILES notation for 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide?
The canonical SMILES for 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide is C[C@@H]1CN(CC(N)C(N)=O)C[C@H](C)O1.
What is the InChIKey of 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide?
The InChIKey is WPXJYHZYQLQYFW-DHBOJHSNSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-6-3-12(4-7(2)14-6)5-8(10)9(11)13/h6-8H,3-5,10H2,1-2H3,(H2,11,13)/t6-,7+,8?.
What are the key properties of 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide?
2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide has a molecular weight of 201.27 g/mol, XLogP of -1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propanamide is sourced from PubChem (CID 104959272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).