6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione

C16H29N3O2 — CID 64965128

IUPAC6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCCC1C(=O)NC(C(C)C)C(=O)N1C1CCCN(CC)C1
InChIInChI=1S/C16H29N3O2/c1-5-13-15(20)17-14(11(3)4)16(21)19(13)12-8-7-9-18(6-2)10-12/h11-14H,5-10H2,1-4H3,(H,17,20)
InChIKeyYGEDPWXHSBGWEL-UHFFFAOYSA-N
MW295.43 g/mol
LogP1.23
Rot. Bonds4

About 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione

6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione (PubChem CID 64965128) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione
PubChem CID64965128
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC Name6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCCC1C(=O)NC(C(C)C)C(=O)N1C1CCCN(CC)C1
InChIInChI=1S/C16H29N3O2/c1-5-13-15(20)17-14(11(3)4)16(21)19(13)12-8-7-9-18(6-2)10-12/h11-14H,5-10H2,1-4H3,(H,17,20)
InChIKeyYGEDPWXHSBGWEL-UHFFFAOYSA-N
XLogP1.23
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

6-ethyl-1-(1-methylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione
CID 64964568
1-cyclobutyl-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64969387
1-cycloheptyl-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64960299
6-ethyl-1-(4-ethylcyclohexyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64964865
3-(1-ethylpiperidin-3-yl)-5-propan-2-ylimidazolidin-4-one
CID 83247949
1-(1-azabicyclo[2.2.2]octan-3-yl)-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64958000
2-cyclopentyl-5-ethyl-3-(1-ethylpiperidin-3-yl)imidazolidin-4-one
CID 83246390
3-cyclopropyl-1-(1-ethylpiperidin-3-yl)-6-methylpiperazine-2,5-dione
CID 64965009
2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one
CID 83245102
1-cyclohexyl-3,6-diethylpiperazine-2,5-dione
CID 64958819
2,5-diethyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one
CID 83245859
3-butan-2-yl-6-ethyl-1-(oxolan-3-yl)piperazine-2,5-dione
CID 64902522

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione (CID 64965128) is 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione is CCC1C(=O)NC(C(C)C)C(=O)N1C1CCCN(CC)C1.
What is the InChIKey of 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione?
The InChIKey is YGEDPWXHSBGWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-5-13-15(20)17-14(11(3)4)16(21)19(13)12-8-7-9-18(6-2)10-12/h11-14H,5-10H2,1-4H3,(H,17,20).
What are the key properties of 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione?
6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione has a molecular weight of 295.43 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-(1-ethylpiperidin-3-yl)-3-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64965128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).