3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide

C22H26N2O4 — CID 17385439

IUPAC3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide
SMILESCOc1cccc(C(=O)NCC2CCN(C(=O)c3cccc(OC)c3)CC2)c1
InChIInChI=1S/C22H26N2O4/c1-27-19-7-3-5-17(13-19)21(25)23-15-16-9-11-24(12-10-16)22(26)18-6-4-8-20(14-18)28-2/h3-8,13-14,16H,9-12,15H2,1-2H3,(H,23,25)
InChIKeyQQPLWFDHNKUNHX-UHFFFAOYSA-N
MW382.46 g/mol
LogP2.99
Rot. Bonds6

About 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide

3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide (PubChem CID 17385439) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide
PubChem CID17385439
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC Name3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide
SMILESCOc1cccc(C(=O)NCC2CCN(C(=O)c3cccc(OC)c3)CC2)c1
InChIInChI=1S/C22H26N2O4/c1-27-19-7-3-5-17(13-19)21(25)23-15-16-9-11-24(12-10-16)22(26)18-6-4-8-20(14-18)28-2/h3-8,13-14,16H,9-12,15H2,1-2H3,(H,23,25)
InChIKeyQQPLWFDHNKUNHX-UHFFFAOYSA-N
XLogP2.99
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-acetylpiperidin-4-yl)methyl]-3-methoxybenzamide
CID 110736146
[3-[4-[[(3,5-dimethoxybenzoyl)amino]methyl]piperidine-1-carbonyl]phenyl] acetate
CID 108927052
[4-[3-[1-(3-methoxybenzoyl)piperidin-4-yl]propyl]piperidin-1-yl]-(3-methoxyphenyl)methanone
CID 23790808
N-[[1-(3,5-dimethoxybenzoyl)piperidin-4-yl]methyl]pyridine-3-carboxamide
CID 108924591
N-[(1-benzylpiperidin-4-yl)methyl]-3-methoxybenzamide
CID 16895714
3-bromo-N-[[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]methyl]benzamide
CID 108935231
[3-[4-[[(4-tert-butylbenzoyl)amino]methyl]piperidine-1-carbonyl]phenyl] acetate
CID 108927152
tert-butyl N-[3-[[1-(3-methoxybenzoyl)piperidin-4-yl]methylamino]-3-oxopropyl]carbamate
CID 108919237
[3-[[1-(2-methoxybenzoyl)piperidin-4-yl]methylcarbamoyl]phenyl] acetate
CID 108927015
3-methoxy-N-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16895960
[3-[4-[[[4-(dimethylamino)benzoyl]amino]methyl]piperidine-1-carbonyl]phenyl] acetate
CID 108927242
3-hydroxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558264

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide?
The IUPAC name of 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide (CID 17385439) is 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide?
The canonical SMILES for 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide is COc1cccc(C(=O)NCC2CCN(C(=O)c3cccc(OC)c3)CC2)c1.
What is the InChIKey of 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide?
The InChIKey is QQPLWFDHNKUNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-27-19-7-3-5-17(13-19)21(25)23-15-16-9-11-24(12-10-16)22(26)18-6-4-8-20(14-18)28-2/h3-8,13-14,16H,9-12,15H2,1-2H3,(H,23,25).
What are the key properties of 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide?
3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide has a molecular weight of 382.46 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[[1-(3-methoxybenzoyl)piperidin-4-yl]methyl]benzamide is sourced from PubChem (CID 17385439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).