cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone

C15H28N2O3 — CID 97040262

IUPACcyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
SMILESCN(CCO)C[C@@H]1COCCN1C(=O)C1CCCCC1
InChIInChI=1S/C15H28N2O3/c1-16(7-9-18)11-14-12-20-10-8-17(14)15(19)13-5-3-2-4-6-13/h13-14,18H,2-12H2,1H3/t14-/m1/s1
InChIKeyLGQSHENRCLMMHT-CQSZACIVSA-N
MW284.40 g/mol
LogP0.72
Rot. Bonds5

About cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone

cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone (PubChem CID 97040262) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Namecyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
PubChem CID97040262
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Namecyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
SMILESCN(CCO)C[C@@H]1COCCN1C(=O)C1CCCCC1
InChIInChI=1S/C15H28N2O3/c1-16(7-9-18)11-14-12-20-10-8-17(14)15(19)13-5-3-2-4-6-13/h13-14,18H,2-12H2,1H3/t14-/m1/s1
InChIKeyLGQSHENRCLMMHT-CQSZACIVSA-N
XLogP0.72
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
CID 71785875
cyclohexyl-[(3R)-3-[(dimethylamino)methyl]morpholin-4-yl]methanone
CID 97040260
1-[(3S)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]-2-phenylethanone
CID 97040365
formic acid;furan-2-yl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
CID 71785985
(3,5-dimethoxyphenyl)-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone;formic acid
CID 71785911
(2,5-dimethylfuran-3-yl)-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone;formic acid
CID 71786001
formic acid;[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]-quinoxalin-2-ylmethanone
CID 71786023
[3-(hydroxymethyl)morpholin-4-yl]-(1-propan-2-ylpiperidin-4-yl)methanone
CID 70650528
1,3-benzodioxol-5-yl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone;formic acid
CID 71785914
(4-aminocyclohexyl)-(3-ethylmorpholin-4-yl)methanone
CID 60847443
cis-(1S,3R)-3-[(3R)-3-ethylmorpholine-4-carbonyl]cyclohexane-1-carboxylic acid
CID 98549374
formic acid;[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]-(3-methoxyphenyl)methanone
CID 71785895

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
The IUPAC name of cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone (CID 97040262) is cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone.
What is the SMILES notation for cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
The canonical SMILES for cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone is CN(CCO)C[C@@H]1COCCN1C(=O)C1CCCCC1.
What is the InChIKey of cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
The InChIKey is LGQSHENRCLMMHT-CQSZACIVSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-16(7-9-18)11-14-12-20-10-8-17(14)15(19)13-5-3-2-4-6-13/h13-14,18H,2-12H2,1H3/t14-/m1/s1.
What are the key properties of cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone has a molecular weight of 284.40 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[(3R)-3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone is sourced from PubChem (CID 97040262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).