1,4-bis(4-methoxyphenyl)piperazine-2,5-dione

C18H18N2O4 — CID 585094

IUPAC1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
SMILESCOc1ccc(N2CC(=O)N(c3ccc(OC)cc3)CC2=O)cc1
InChIInChI=1S/C18H18N2O4/c1-23-15-7-3-13(4-8-15)19-11-18(22)20(12-17(19)21)14-5-9-16(24-2)10-6-14/h3-10H,11-12H2,1-2H3
InChIKeyUSVMSKJDIQQFCA-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.08
Rot. Bonds4

About 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione

1,4-bis(4-methoxyphenyl)piperazine-2,5-dione (PubChem CID 585094) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione.

Molecular Properties

Compound Name1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
PubChem CID585094
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC Name1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
SMILESCOc1ccc(N2CC(=O)N(c3ccc(OC)cc3)CC2=O)cc1
InChIInChI=1S/C18H18N2O4/c1-23-15-7-3-13(4-8-15)19-11-18(22)20(12-17(19)21)14-5-9-16(24-2)10-6-14/h3-10H,11-12H2,1-2H3
InChIKeyUSVMSKJDIQQFCA-UHFFFAOYSA-N
XLogP2.08
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methoxyphenyl)pyrrolidine-2,4-dione
CID 79515540
1-(4-methoxyphenyl)azepan-2-one
CID 66742326
3-(4-methoxyphenyl)-1-phenyl-2-sulfanylideneimidazolidin-4-one
CID 682116
1-(4-methoxyphenyl)piperazin-2-one
CID 15400020
1-(4-methoxyphenyl)-1,4-diazepane-2,5-dione
CID 64955856
4-(4-methoxyphenyl)-1,2,4-dithiazolidin-3-one
CID 166650846
1-(4-methoxyphenyl)-2,3-dihydropyridin-6-one
CID 67005013
3-acetyl-1-(4-methoxyphenyl)pyrrolidine-2,4-dione
CID 18926731
1-(4-methoxyphenyl)-4-(sulfanylmethyl)pyrrolidin-2-one
CID 168670171
1,5-bis(4-methoxyphenyl)piperidin-2-one
CID 153340032
1-(4-methoxyphenyl)-1,4-diazocan-2-one
CID 117016195
3-(4-methoxyphenyl)-3-azabicyclo[3.1.0]hexan-2-one
CID 84777227

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione?
The IUPAC name of 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione (CID 585094) is 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione.
What is the SMILES notation for 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione?
The canonical SMILES for 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione is COc1ccc(N2CC(=O)N(c3ccc(OC)cc3)CC2=O)cc1.
What is the InChIKey of 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione?
The InChIKey is USVMSKJDIQQFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-23-15-7-3-13(4-8-15)19-11-18(22)20(12-17(19)21)14-5-9-16(24-2)10-6-14/h3-10H,11-12H2,1-2H3.
What are the key properties of 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione?
1,4-bis(4-methoxyphenyl)piperazine-2,5-dione has a molecular weight of 326.35 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(4-methoxyphenyl)piperazine-2,5-dione is sourced from PubChem (CID 585094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).