2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone

C19H34N4O3 — CID 55412886

IUPAC2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone
SMILESCC1CCCC(C)N1C(=O)CN1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C19H34N4O3/c1-16-4-3-5-17(2)23(16)19(25)15-21-8-6-20(7-9-21)14-18(24)22-10-12-26-13-11-22/h16-17H,3-15H2,1-2H3
InChIKeyUYPXICJJEOPXKA-UHFFFAOYSA-N
MW366.51 g/mol
LogP0.25
Rot. Bonds4

About 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone

2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone (PubChem CID 55412886) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone
PubChem CID55412886
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC Name2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone
SMILESCC1CCCC(C)N1C(=O)CN1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C19H34N4O3/c1-16-4-3-5-17(2)23(16)19(25)15-21-8-6-20(7-9-21)14-18(24)22-10-12-26-13-11-22/h16-17H,3-15H2,1-2H3
InChIKeyUYPXICJJEOPXKA-UHFFFAOYSA-N
XLogP0.25
TPSA56.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 50.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone with MolForge

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Related Compounds

Morpholinium, 4,4'-(1,4-piperazinediylbis(1-oxopropylene))bis(4-methyl-, diiodide
CID 199521
1-(4-Acetylpiperazin-1-yl)-2-[3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethanone
CID 56802300
2-(2-Methylpiperidin-1-yl)-1-[4-[2-(2-methylpiperidin-1-yl)acetyl]piperazin-1-yl]ethanone
CID 3226817
2-(2-Ethylpiperidin-1-yl)-1-(2-methylmorpholin-4-yl)ethanone
CID 51074713
2-(4-Methylmorpholin-4-ium-4-yl)-1-[4-[2-(4-methylmorpholin-4-ium-4-yl)propanoyl]piperazin-1-yl]propan-1-one
CID 199522
1-Morpholin-4-yl-2-(4-piperidin-1-ylpiperidin-1-yl)ethanone
CID 1439625
2-(4-Methylmorpholin-4-ium-4-yl)-1-[4-[3-(4-methylmorpholin-4-ium-4-yl)propanoyl]piperazin-1-yl]propan-1-one
CID 24840362
Acetaldehyde;2-(2-methylpiperidin-1-yl)-1-[4-[2-(2-methylpiperidin-1-yl)acetyl]piperazin-1-yl]ethanone
CID 90660619
1-Morpholin-4-yl-2-(4-piperidin-1-ylpiperidin-1-yl)propan-1-one
CID 3229561
4-{2-[2-(2-Morpholin-4-ylethyl)piperidin-1-yl]-2-oxoethyl}piperazin-2-one
CID 56759513
(2R)-2-amino-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-3-morpholin-4-ylpropan-1-one
CID 23540196
1-(4-Cyclopentylpiperazin-1-yl)-2-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]ethanone
CID 57442385

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone (CID 55412886) is 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone is CC1CCCC(C)N1C(=O)CN1CCN(CC(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is UYPXICJJEOPXKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c1-16-4-3-5-17(2)23(16)19(25)15-21-8-6-20(7-9-21)14-18(24)22-10-12-26-13-11-22/h16-17H,3-15H2,1-2H3.
What are the key properties of 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 366.51 g/mol, XLogP of 0.25, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 55412886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).