(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one

C12H24N2O2 — CID 103928484

IUPAC(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one
SMILESCC1CN(C(=O)[C@H](N)C(C)(C)C)C(C)CO1
InChIInChI=1S/C12H24N2O2/c1-8-7-16-9(2)6-14(8)11(15)10(13)12(3,4)5/h8-10H,6-7,13H2,1-5H3/t8?,9?,10-/m0/s1
InChIKeySFSKOSINJWWRFB-RTBKNWGFSA-N
MW228.34 g/mol
LogP1.00
Rot. Bonds1

About (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one

(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one (PubChem CID 103928484) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one
PubChem CID103928484
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one
SMILESCC1CN(C(=O)[C@H](N)C(C)(C)C)C(C)CO1
InChIInChI=1S/C12H24N2O2/c1-8-7-16-9(2)6-14(8)11(15)10(13)12(3,4)5/h8-10H,6-7,13H2,1-5H3/t8?,9?,10-/m0/s1
InChIKeySFSKOSINJWWRFB-RTBKNWGFSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,5-dimethylmorpholin-4-yl)-2-sulfanylpropan-1-one
CID 107022948
1-(2,5-dimethylmorpholin-4-yl)-2,2-difluoroethanone
CID 103515326
(2R)-2-amino-3,3-dimethyl-1-(3-methylmorpholin-4-yl)butan-1-one
CID 103928483
(2S)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3-methylpentan-1-one
CID 61172286
2-amino-1-(2,5-dimethylpiperidin-1-yl)-3,3-dimethylbutan-1-one
CID 77077441
(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-4-methylsulfanylbutan-1-one
CID 104906985
(2S)-2-amino-3,3-dimethyl-1-(2-methyl-1,4-oxazepan-4-yl)butan-1-one;hydrochloride
CID 119771958
(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3-(4-hydroxyphenyl)propan-1-one
CID 104904754
cyclobutyl-(2,5-dimethylmorpholin-4-yl)methanone
CID 110727653
(2S)-2-amino-3,3-dimethyl-1-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)butan-1-one
CID 79938834
(2R)-2-amino-1-(2,6-dimethylpiperidin-1-yl)-3,3-dimethylbutan-1-one
CID 103928383
2-[(2,5-dimethylmorpholine-4-carbonyl)amino]-2-methylpropanoic acid
CID 61266346

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one?
The IUPAC name of (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one (CID 103928484) is (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one.
What is the SMILES notation for (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one?
The canonical SMILES for (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one is CC1CN(C(=O)[C@H](N)C(C)(C)C)C(C)CO1.
What is the InChIKey of (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one?
The InChIKey is SFSKOSINJWWRFB-RTBKNWGFSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-8-7-16-9(2)6-14(8)11(15)10(13)12(3,4)5/h8-10H,6-7,13H2,1-5H3/t8?,9?,10-/m0/s1.
What are the key properties of (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one?
(2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one has a molecular weight of 228.34 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-(2,5-dimethylmorpholin-4-yl)-3,3-dimethylbutan-1-one is sourced from PubChem (CID 103928484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).