2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone

C11H22N2O4 — CID 62013792

IUPAC2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone
SMILESCOCC(O)CN(C)CC(=O)N1CCOCC1
InChIInChI=1S/C11H22N2O4/c1-12(7-10(14)9-16-2)8-11(15)13-3-5-17-6-4-13/h10,14H,3-9H2,1-2H3
InChIKeyRHKKMQOBTYOSSH-UHFFFAOYSA-N
MW246.31 g/mol
LogP-1.22
Rot. Bonds6

About 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone

2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone (PubChem CID 62013792) has the molecular formula C11H22N2O4 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone
PubChem CID62013792
Molecular FormulaC11H22N2O4
Molecular Weight246.31 g/mol
Exact Mass246.16
IUPAC Name2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone
SMILESCOCC(O)CN(C)CC(=O)N1CCOCC1
InChIInChI=1S/C11H22N2O4/c1-12(7-10(14)9-16-2)8-11(15)13-3-5-17-6-4-13/h10,14H,3-9H2,1-2H3
InChIKeyRHKKMQOBTYOSSH-UHFFFAOYSA-N
XLogP-1.22
TPSA62.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 5-1.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-(4-methylsulfonylpiperazin-1-yl)ethanone
CID 62016338
1-(3,5-dimethylpiperidin-1-yl)-2-[(2-hydroxy-3-methoxypropyl)-methylamino]ethanone
CID 62013810
2-[methyl(methylaminomethyl)amino]-1-morpholin-4-ylethanone
CID 177179015
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-[(2-hydroxy-3-methoxypropyl)-methylamino]ethanone
CID 62015561
2-[(1-amino-2-methylpropan-2-yl)-methylamino]-1-morpholin-4-ylethanone
CID 62007959
2-[methyl(2-methylsulfanylethyl)amino]-1-morpholin-4-ylethanone
CID 78815658
2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetonitrile
CID 60699929
2-[methyl-[[(1R,3R)-3-methylcyclopentyl]methyl]amino]-1-morpholin-4-ylethanone
CID 124864588
1-[(2-hydroxy-3-methoxypropyl)-methylamino]pentan-2-one
CID 62041400
2-[2-methoxyethyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetic acid
CID 54969051
2-[[2-(3-chlorophenyl)-2-hydroxyethyl]-methylamino]-1-morpholin-4-ylethanone
CID 111487350
3-[methyl-(3-morpholin-4-yl-3-oxopropyl)amino]-1-morpholin-4-ylpropan-1-one
CID 23422467

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone (CID 62013792) is 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone is COCC(O)CN(C)CC(=O)N1CCOCC1.
What is the InChIKey of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone?
The InChIKey is RHKKMQOBTYOSSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4/c1-12(7-10(14)9-16-2)8-11(15)13-3-5-17-6-4-13/h10,14H,3-9H2,1-2H3.
What are the key properties of 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone?
2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone has a molecular weight of 246.31 g/mol, XLogP of -1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-3-methoxypropyl)-methylamino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 62013792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).