1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione

C15H20N2O4 — CID 64956816

IUPAC1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)CN(c2cc(OC)cc(OC)c2)C1=O
InChIInChI=1S/C15H20N2O4/c1-4-5-13-15(19)17(9-14(18)16-13)10-6-11(20-2)8-12(7-10)21-3/h6-8,13H,4-5,9H2,1-3H3,(H,16,18)
InChIKeyCUYWZALOPMMBHP-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.34
Rot. Bonds5

About 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione

1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione (PubChem CID 64956816) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione
PubChem CID64956816
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)CN(c2cc(OC)cc(OC)c2)C1=O
InChIInChI=1S/C15H20N2O4/c1-4-5-13-15(19)17(9-14(18)16-13)10-6-11(20-2)8-12(7-10)21-3/h6-8,13H,4-5,9H2,1-3H3,(H,16,18)
InChIKeyCUYWZALOPMMBHP-UHFFFAOYSA-N
XLogP1.34
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ucm 793
CID 24750192
1-(3,5-Dimethoxyphenyl)piperazine
CID 2736205
N-{2-[(3-Methoxyphenyl)-phenylamino]ethyl}acetamide
CID 16656789
N-{2-[(3-Methoxyphenyl)-phenylamino]ethyl}butanamide
CID 24750071
N-[2-(3-methoxy-N-(3-methoxyphenyl)anilino)ethyl]acetamide
CID 24750077
N-{3-[(3-Methoxyphenyl)-methylamino]propyl}acetamide
CID 24750193
N-(3,5-dimethoxyphenyl)propanamide
CID 702220
N-(3,5-dimethoxyphenyl)-2-methylpropanamide
CID 885768
4-Morpholineacetamide, N-(3-methoxyphenyl)-
CID 218187
N-(3,5-Dimethoxyphenyl)-4-({[2-(4-methylpiperidin-1-YL)-3,4-dioxocyclobut-1-EN-1-YL]amino}methyl)cyclohexane-1-carboxamide
CID 9550435
N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
CID 719564
N-(3,5-dimethoxyphenyl)-3-(4-ethylpiperazin-1-yl)propanamide
CID 719567

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione?
The IUPAC name of 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione (CID 64956816) is 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione.
What is the SMILES notation for 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione?
The canonical SMILES for 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione is CCCC1NC(=O)CN(c2cc(OC)cc(OC)c2)C1=O.
What is the InChIKey of 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione?
The InChIKey is CUYWZALOPMMBHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-4-5-13-15(19)17(9-14(18)16-13)10-6-11(20-2)8-12(7-10)21-3/h6-8,13H,4-5,9H2,1-3H3,(H,16,18).
What are the key properties of 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione?
1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione has a molecular weight of 292.33 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxyphenyl)-3-propylpiperazine-2,5-dione is sourced from PubChem (CID 64956816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).