1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone

C15H28N2O3 — CID 115758447

IUPAC1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone
SMILESCC1CN(C(=O)CN(C)CC2(O)CCCC2)CC(C)O1
InChIInChI=1S/C15H28N2O3/c1-12-8-17(9-13(2)20-12)14(18)10-16(3)11-15(19)6-4-5-7-15/h12-13,19H,4-11H2,1-3H3
InChIKeyJMTPNIURHUVMCW-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.86
Rot. Bonds4

About 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone

1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone (PubChem CID 115758447) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone
PubChem CID115758447
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone
SMILESCC1CN(C(=O)CN(C)CC2(O)CCCC2)CC(C)O1
InChIInChI=1S/C15H28N2O3/c1-12-8-17(9-13(2)20-12)14(18)10-16(3)11-15(19)6-4-5-7-15/h12-13,19H,4-11H2,1-3H3
InChIKeyJMTPNIURHUVMCW-UHFFFAOYSA-N
XLogP0.86
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone (CID 115758447) is 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone is CC1CN(C(=O)CN(C)CC2(O)CCCC2)CC(C)O1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone?
The InChIKey is JMTPNIURHUVMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-12-8-17(9-13(2)20-12)14(18)10-16(3)11-15(19)6-4-5-7-15/h12-13,19H,4-11H2,1-3H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone?
1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone has a molecular weight of 284.40 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone is sourced from PubChem (CID 115758447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).