(2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one

C10H20N2O2 — CID 93111667

IUPAC(2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one
SMILESCC(C)[C@@H](N)C(=O)N1CCOC[C@H]1C
InChIInChI=1S/C10H20N2O2/c1-7(2)9(11)10(13)12-4-5-14-6-8(12)3/h7-9H,4-6,11H2,1-3H3/t8-,9-/m1/s1
InChIKeyZXIMBIIQEZNTSF-RKDXNWHRSA-N
MW200.28 g/mol
LogP0.22
Rot. Bonds2

About (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one

(2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one (PubChem CID 93111667) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one
PubChem CID93111667
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one
SMILESCC(C)[C@@H](N)C(=O)N1CCOC[C@H]1C
InChIInChI=1S/C10H20N2O2/c1-7(2)9(11)10(13)12-4-5-14-6-8(12)3/h7-9H,4-6,11H2,1-3H3/t8-,9-/m1/s1
InChIKeyZXIMBIIQEZNTSF-RKDXNWHRSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-3,3-dimethyl-1-(3-methylmorpholin-4-yl)butan-1-one
CID 103928483
2-amino-4-methyl-1-[(3R)-3-methylmorpholin-4-yl]pentan-1-one
CID 106774404
2-amino-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one
CID 106774483
2-methoxy-1-(3-methylmorpholin-4-yl)propan-1-one
CID 115588328
N'-hydroxy-3-methyl-2-(3-methylmorpholine-4-carbonyl)butanimidamide
CID 76926390
3-amino-2,2,3-trimethyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one
CID 106774586
2-amino-1-[(3R)-3-methylmorpholin-4-yl]-4-methylsulfonylbutan-1-one
CID 106774307
2-amino-3-methyl-1-morpholin-4-ylbutan-1-one
CID 22492154
2-amino-1-(3-methylmorpholin-4-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 113279808
2-chloro-1-(3-methyl-1,4-oxazepan-4-yl)propan-1-one
CID 127001228
2-amino-3-(4-hydroxyphenyl)-1-[(3R)-3-methylmorpholin-4-yl]propan-1-one
CID 106774255
[(3S)-3-methylmorpholin-4-yl]-(oxan-4-yl)methanone
CID 95614757

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one?
The IUPAC name of (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one (CID 93111667) is (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one.
What is the SMILES notation for (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one?
The canonical SMILES for (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one is CC(C)[C@@H](N)C(=O)N1CCOC[C@H]1C.
What is the InChIKey of (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one?
The InChIKey is ZXIMBIIQEZNTSF-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)9(11)10(13)12-4-5-14-6-8(12)3/h7-9H,4-6,11H2,1-3H3/t8-,9-/m1/s1.
What are the key properties of (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one?
(2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one has a molecular weight of 200.28 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-methyl-1-[(3R)-3-methylmorpholin-4-yl]butan-1-one is sourced from PubChem (CID 93111667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).