1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one

C11H21NO2 — CID 166684101

IUPAC1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one
SMILESCC[C@@H]1CN(C(=O)C(C)(C)C)CCO1
InChIInChI=1S/C11H21NO2/c1-5-9-8-12(6-7-14-9)10(13)11(2,3)4/h9H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyCWRVJBXKTMQXSV-SECBINFHSA-N
MW199.29 g/mol
LogP1.67
Rot. Bonds1

About 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one

1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one (PubChem CID 166684101) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one.

Molecular Properties

Compound Name1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one
PubChem CID166684101
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one
SMILESCC[C@@H]1CN(C(=O)C(C)(C)C)CCO1
InChIInChI=1S/C11H21NO2/c1-5-9-8-12(6-7-14-9)10(13)11(2,3)4/h9H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyCWRVJBXKTMQXSV-SECBINFHSA-N
XLogP1.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(bromomethyl)morpholin-4-yl]-2,2-dimethylpropan-1-one
CID 81211878
2-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]acetic acid
CID 66420375
2-ethylmorpholine-4-carboxylic acid
CID 121455686
3-[4-(2,2-dimethylpropanoyl)morpholin-2-yl]-2,2-dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one
CID 166881497
2-(4-aminophenyl)-1-(2-ethylmorpholin-4-yl)-2-methylpropan-1-one
CID 80556940
4-(2,2-dimethylpropanoyl)morpholine-2-carboxylic acid
CID 54595495
3-[2-(hydroxymethyl)morpholin-4-yl]-2,2-dimethyl-3-oxopropanoic acid
CID 82820748
2-fluoro-1-[2-(hydroxymethyl)morpholin-4-yl]-2-methylpropan-1-one
CID 130165226
(Z)-1-[(2R)-2-ethylmorpholin-4-yl]-2-methylpent-2-en-1-one
CID 95154056
2-[(2S)-4-(2,2-dimethylbutanoyl)morpholin-2-yl]acetic acid
CID 124515405
(1-aminocyclopropyl)-(2-ethylmorpholin-4-yl)methanone
CID 65466783
1-[2-[2-(hydroxymethyl)morpholine-4-carbonyl]pyrrolidin-1-yl]-2,2-dimethylpropan-1-one
CID 81197204

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one?
The IUPAC name of 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one (CID 166684101) is 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one.
What is the SMILES notation for 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one?
The canonical SMILES for 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one is CC[C@@H]1CN(C(=O)C(C)(C)C)CCO1.
What is the InChIKey of 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one?
The InChIKey is CWRVJBXKTMQXSV-SECBINFHSA-N. The full InChI is InChI=1S/C11H21NO2/c1-5-9-8-12(6-7-14-9)10(13)11(2,3)4/h9H,5-8H2,1-4H3/t9-/m1/s1.
What are the key properties of 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one?
1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one has a molecular weight of 199.29 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-ethylmorpholin-4-yl]-2,2-dimethylpropan-1-one is sourced from PubChem (CID 166684101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).