3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide

C24H30N2O4 — CID 46378959

IUPAC3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCCC2CCN(C(=O)c3ccc(C)cc3)CC2)c1
InChIInChI=1S/C24H30N2O4/c1-17-4-6-19(7-5-17)24(28)26-12-9-18(10-13-26)8-11-25-23(27)20-14-21(29-2)16-22(15-20)30-3/h4-7,14-16,18H,8-13H2,1-3H3,(H,25,27)
InChIKeyMRJVAKJNCWDJPH-UHFFFAOYSA-N
MW410.51 g/mol
LogP3.68
Rot. Bonds7

About 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide

3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide (PubChem CID 46378959) has the molecular formula C24H30N2O4 and a molecular weight of 410.51 g/mol. Its IUPAC name is 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide
PubChem CID46378959
Molecular FormulaC24H30N2O4
Molecular Weight410.51 g/mol
Exact Mass410.22
IUPAC Name3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide
SMILESCOc1cc(OC)cc(C(=O)NCCC2CCN(C(=O)c3ccc(C)cc3)CC2)c1
InChIInChI=1S/C24H30N2O4/c1-17-4-6-19(7-5-17)24(28)26-12-9-18(10-13-26)8-11-25-23(27)20-14-21(29-2)16-22(15-20)30-3/h4-7,14-16,18H,8-13H2,1-3H3,(H,25,27)
InChIKeyMRJVAKJNCWDJPH-UHFFFAOYSA-N
XLogP3.68
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.51
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide 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-[2-(1-benzoylpiperidin-4-yl)ethyl]-3-methylbenzamide
CID 46378991
N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]cyclohexanecarboxamide
CID 46378930
2,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzenesulfonamide
CID 53103803
[3-[4-[[(3,5-dimethoxybenzoyl)amino]methyl]piperidine-1-carbonyl]phenyl] acetate
CID 108927052
3-methoxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
CID 108550302
3-amino-N-(2-cyclopropylethyl)-5-methoxybenzamide
CID 81092217
3,4-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzenesulfonamide
CID 53103804
3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide
CID 17385439
3,5-dimethoxy-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 63628220
N-[2-(1-benzoylpiperidin-4-yl)ethyl]-2-methylbenzamide
CID 46378988
3,5-dimethoxy-N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide
CID 2947044
N-[[1-(3,5-dimethoxybenzoyl)piperidin-4-yl]methyl]pyridine-3-carboxamide
CID 108924591

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide?
The IUPAC name of 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide (CID 46378959) is 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide?
The canonical SMILES for 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide is COc1cc(OC)cc(C(=O)NCCC2CCN(C(=O)c3ccc(C)cc3)CC2)c1.
What is the InChIKey of 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide?
The InChIKey is MRJVAKJNCWDJPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O4/c1-17-4-6-19(7-5-17)24(28)26-12-9-18(10-13-26)8-11-25-23(27)20-14-21(29-2)16-22(15-20)30-3/h4-7,14-16,18H,8-13H2,1-3H3,(H,25,27).
What are the key properties of 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide?
3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide has a molecular weight of 410.51 g/mol, XLogP of 3.68, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-[2-[1-(4-methylbenzoyl)piperidin-4-yl]ethyl]benzamide is sourced from PubChem (CID 46378959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).