1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone

C15H30N4O2 — CID 63265431

IUPAC1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone
SMILESCC1CN(C(=O)CN(C)CCN2CCNCC2)CC(C)O1
InChIInChI=1S/C15H30N4O2/c1-13-10-19(11-14(2)21-13)15(20)12-17(3)8-9-18-6-4-16-5-7-18/h13-14,16H,4-12H2,1-3H3
InChIKeyHNQWPUCKRDWBHR-UHFFFAOYSA-N
MW298.43 g/mol
LogP-0.54
Rot. Bonds5

About 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone

1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone (PubChem CID 63265431) has the molecular formula C15H30N4O2 and a molecular weight of 298.43 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone
PubChem CID63265431
Molecular FormulaC15H30N4O2
Molecular Weight298.43 g/mol
Exact Mass298.24
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone
SMILESCC1CN(C(=O)CN(C)CCN2CCNCC2)CC(C)O1
InChIInChI=1S/C15H30N4O2/c1-13-10-19(11-14(2)21-13)15(20)12-17(3)8-9-18-6-4-16-5-7-18/h13-14,16H,4-12H2,1-3H3
InChIKeyHNQWPUCKRDWBHR-UHFFFAOYSA-N
XLogP-0.54
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]-methylamino]-1-piperazin-1-ylethanone
CID 119915244
2-[azetidin-3-yl(methyl)amino]-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 66187363
N,5-dimethyl-N-(2-piperazin-1-ylethyl)oxolane-2-carboxamide
CID 81331120
2-chloro-N-methyl-N-(2-piperazin-1-ylethyl)prop-2-en-1-amine
CID 63266542
1-(2,6-dimethylmorpholin-4-yl)-2-[(1-hydroxycyclopentyl)methyl-methylamino]ethanone
CID 115758447
methyl N-[2-[methyl(2-piperazin-1-ylethyl)amino]acetyl]carbamate
CID 55167527
1-(2,6-dimethylmorpholin-4-yl)-2-piperidin-4-ylethanone
CID 24711054
2-[3-fluoropropyl(methyl)amino]-1-piperazin-1-ylethanone
CID 81113401
3-amino-1-(2,6-dimethylmorpholin-4-yl)propan-1-one
CID 16784840
1-(2,6-dimethylmorpholin-4-yl)-2-[(4-methoxyphenyl)methyl-methylamino]ethanone
CID 86911554
1-(1,4-diazepan-1-yl)-2-[3-(dimethylamino)propyl-methylamino]ethanone
CID 55226180
(2R)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-one
CID 97087177

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone (CID 63265431) is 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone is CC1CN(C(=O)CN(C)CCN2CCNCC2)CC(C)O1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone?
The InChIKey is HNQWPUCKRDWBHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O2/c1-13-10-19(11-14(2)21-13)15(20)12-17(3)8-9-18-6-4-16-5-7-18/h13-14,16H,4-12H2,1-3H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone?
1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone has a molecular weight of 298.43 g/mol, XLogP of -0.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-2-[methyl(2-piperazin-1-ylethyl)amino]ethanone is sourced from PubChem (CID 63265431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).