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

C15H28N2O3 — CID 71785875

IUPACcyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
SMILESCN(CCO)CC1COCCN1C(=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
InChIKeyLGQSHENRCLMMHT-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.72
Rot. Bonds5

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

cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone (PubChem CID 71785875) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Namecyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
PubChem CID71785875
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Namecyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone
SMILESCN(CCO)CC1COCCN1C(=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
InChIKeyLGQSHENRCLMMHT-UHFFFAOYSA-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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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
The IUPAC name of cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone (CID 71785875) is cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone.
What is the SMILES notation for cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
The canonical SMILES for cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone is CN(CCO)CC1COCCN1C(=O)C1CCCCC1.
What is the InChIKey of cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
The InChIKey is LGQSHENRCLMMHT-UHFFFAOYSA-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.
What are the key properties of cyclohexyl-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone?
cyclohexyl-[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-[3-[[2-hydroxyethyl(methyl)amino]methyl]morpholin-4-yl]methanone is sourced from PubChem (CID 71785875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).