4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one

C20H22N2O5 — CID 110644929

IUPAC4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one
SMILESCOc1ccc(C2C(=O)NCCN2C(=O)c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C20H22N2O5/c1-25-15-6-4-13(5-7-15)18-19(23)21-8-9-22(18)20(24)14-10-16(26-2)12-17(11-14)27-3/h4-7,10-12,18H,8-9H2,1-3H3,(H,21,23)
InChIKeyNGWXJNKQFSQKGE-UHFFFAOYSA-N
MW370.41 g/mol
LogP2.03
Rot. Bonds5

About 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one

4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one (PubChem CID 110644929) has the molecular formula C20H22N2O5 and a molecular weight of 370.41 g/mol. Its IUPAC name is 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one.

Molecular Properties

Compound Name4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one
PubChem CID110644929
Molecular FormulaC20H22N2O5
Molecular Weight370.41 g/mol
Exact Mass370.15
IUPAC Name4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one
SMILESCOc1ccc(C2C(=O)NCCN2C(=O)c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C20H22N2O5/c1-25-15-6-4-13(5-7-15)18-19(23)21-8-9-22(18)20(24)14-10-16(26-2)12-17(11-14)27-3/h4-7,10-12,18H,8-9H2,1-3H3,(H,21,23)
InChIKeyNGWXJNKQFSQKGE-UHFFFAOYSA-N
XLogP2.03
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3-chlorophenyl)-4-(3,5-dimethoxybenzoyl)piperazin-2-one
CID 110656807
3-(4-methoxyphenyl)-4-(2,3,4-trifluorobenzoyl)piperazin-2-one
CID 110420415
3-(4-methoxyphenyl)-4-[3-(4-methoxyphenyl)propanoyl]piperazin-2-one
CID 110420424
4-(cyclohexanecarbonyl)-3-(4-methoxyphenyl)piperazin-2-one
CID 110644909
4-(adamantane-1-carbonyl)-3-(4-methoxyphenyl)piperazin-2-one
CID 110644969
4-(3,4-dimethoxybenzoyl)-3-phenylpiperazin-2-one
CID 110644585
4-[2-(4-fluorophenyl)acetyl]-3-(4-methoxyphenyl)piperazin-2-one
CID 110420396
4-[2-(4-chlorophenoxy)acetyl]-3-(4-methoxyphenyl)piperazin-2-one
CID 110644941
1-[2-(4-fluorophenyl)-3-oxopiperazin-1-yl]-5-(4-methoxyphenyl)pentane-1,5-dione
CID 110426013
4-(3-amino-5-methoxybenzoyl)-3-methylpiperazin-2-one
CID 81091850
(3S)-4-[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]-3-phenylpiperazin-2-one
CID 52909331
4-(4-methoxybenzoyl)-3-propan-2-ylpiperazin-2-one
CID 110873327

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one?
The IUPAC name of 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one (CID 110644929) is 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one.
What is the SMILES notation for 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one?
The canonical SMILES for 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one is COc1ccc(C2C(=O)NCCN2C(=O)c2cc(OC)cc(OC)c2)cc1.
What is the InChIKey of 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one?
The InChIKey is NGWXJNKQFSQKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O5/c1-25-15-6-4-13(5-7-15)18-19(23)21-8-9-22(18)20(24)14-10-16(26-2)12-17(11-14)27-3/h4-7,10-12,18H,8-9H2,1-3H3,(H,21,23).
What are the key properties of 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one?
4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one has a molecular weight of 370.41 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxybenzoyl)-3-(4-methoxyphenyl)piperazin-2-one is sourced from PubChem (CID 110644929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).