1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide

C24H27N3O6 — CID 55718979

IUPAC1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide
SMILESCOc1cc(OC)cc(C(=O)N2CCC(C(=O)Nc3cccc(N4CCOC4=O)c3)CC2)c1
InChIInChI=1S/C24H27N3O6/c1-31-20-12-17(13-21(15-20)32-2)23(29)26-8-6-16(7-9-26)22(28)25-18-4-3-5-19(14-18)27-10-11-33-24(27)30/h3-5,12-16H,6-11H2,1-2H3,(H,25,28)
InChIKeyPVSYCCSVGPQJQK-UHFFFAOYSA-N
MW453.50 g/mol
LogP3.15
Rot. Bonds6

About 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide

1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide (PubChem CID 55718979) has the molecular formula C24H27N3O6 and a molecular weight of 453.50 g/mol. Its IUPAC name is 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide
PubChem CID55718979
Molecular FormulaC24H27N3O6
Molecular Weight453.50 g/mol
Exact Mass453.19
IUPAC Name1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide
SMILESCOc1cc(OC)cc(C(=O)N2CCC(C(=O)Nc3cccc(N4CCOC4=O)c3)CC2)c1
InChIInChI=1S/C24H27N3O6/c1-31-20-12-17(13-21(15-20)32-2)23(29)26-8-6-16(7-9-26)22(28)25-18-4-3-5-19(14-18)27-10-11-33-24(27)30/h3-5,12-16H,6-11H2,1-2H3,(H,25,28)
InChIKeyPVSYCCSVGPQJQK-UHFFFAOYSA-N
XLogP3.15
TPSA97.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.50
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide 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

N-(3-chlorophenyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide
CID 1072800
(2S)-2-N-(4-methoxyphenyl)-1-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]pyrrolidine-1,2-dicarboxamide
CID 52539601
1-(3,5-dimethoxybenzoyl)-N-(3-fluoro-4-methoxyphenyl)piperidine-4-carboxamide
CID 55797447
N-(2-aminophenyl)-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide
CID 119422420
(3S)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-3-carboxamide
CID 81118205
2-(4-methoxyphenyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]azepane-1-carboxamide
CID 51115399
1-(3,5-dimethoxybenzoyl)-N-[4-(2-methoxyphenoxy)phenyl]piperidine-4-carboxamide
CID 46471892
1-(3,4-dimethylbenzoyl)-N-(3-methoxyphenyl)piperidine-4-carboxamide
CID 113007461
1-(3,5-dimethoxybenzoyl)-N-[3-(2-pyridin-2-ylethynyl)phenyl]piperidine-4-carboxamide
CID 55718668
N-(4-bromophenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
CID 39355313
1-(3,5-dimethoxybenzoyl)-N-(2-ethylphenyl)piperidine-4-carboxamide
CID 113006606
methyl 4-[[1-(3-methoxybenzoyl)piperidine-4-carbonyl]amino]benzoate
CID 113008009

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide?
The IUPAC name of 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide (CID 55718979) is 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide is COc1cc(OC)cc(C(=O)N2CCC(C(=O)Nc3cccc(N4CCOC4=O)c3)CC2)c1.
What is the InChIKey of 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide?
The InChIKey is PVSYCCSVGPQJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O6/c1-31-20-12-17(13-21(15-20)32-2)23(29)26-8-6-16(7-9-26)22(28)25-18-4-3-5-19(14-18)27-10-11-33-24(27)30/h3-5,12-16H,6-11H2,1-2H3,(H,25,28).
What are the key properties of 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide?
1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide has a molecular weight of 453.50 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxybenzoyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]piperidine-4-carboxamide is sourced from PubChem (CID 55718979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).