2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone

C19H34N4O3 — CID 55412865

IUPAC2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone
SMILESCCC1CCCCN1C(=O)CN1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C19H34N4O3/c1-2-17-5-3-4-6-23(17)19(25)16-21-9-7-20(8-10-21)15-18(24)22-11-13-26-14-12-22/h17H,2-16H2,1H3
InChIKeyFACDARUTMHSWPZ-UHFFFAOYSA-N
MW366.51 g/mol
LogP0.25
Rot. Bonds5

About 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone

2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone (PubChem CID 55412865) has the molecular formula C19H34N4O3 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone
PubChem CID55412865
Molecular FormulaC19H34N4O3
Molecular Weight366.51 g/mol
Exact Mass366.26
IUPAC Name2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone
SMILESCCC1CCCCN1C(=O)CN1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C19H34N4O3/c1-2-17-5-3-4-6-23(17)19(25)16-21-9-7-20(8-10-21)15-18(24)22-11-13-26-14-12-22/h17H,2-16H2,1H3
InChIKeyFACDARUTMHSWPZ-UHFFFAOYSA-N
XLogP0.25
TPSA56.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
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

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone (CID 55412865) is 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone is CCC1CCCCN1C(=O)CN1CCN(CC(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is FACDARUTMHSWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O3/c1-2-17-5-3-4-6-23(17)19(25)16-21-9-7-20(8-10-21)15-18(24)22-11-13-26-14-12-22/h17H,2-16H2,1H3.
What are the key properties of 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone?
2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 366.51 g/mol, XLogP of 0.25, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 55412865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).