3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide

C22H26N2O5 — CID 108550372

IUPAC3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
SMILESCOc1cccc(C(=O)NC2CCN(C(=O)COc3ccccc3OC)CC2)c1
InChIInChI=1S/C22H26N2O5/c1-27-18-7-5-6-16(14-18)22(26)23-17-10-12-24(13-11-17)21(25)15-29-20-9-4-3-8-19(20)28-2/h3-9,14,17H,10-13,15H2,1-2H3,(H,23,26)
InChIKeyYQXJZXBCJJYWEI-UHFFFAOYSA-N
MW398.46 g/mol
LogP2.50
Rot. Bonds7

About 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide

3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide (PubChem CID 108550372) has the molecular formula C22H26N2O5 and a molecular weight of 398.46 g/mol. Its IUPAC name is 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
PubChem CID108550372
Molecular FormulaC22H26N2O5
Molecular Weight398.46 g/mol
Exact Mass398.18
IUPAC Name3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
SMILESCOc1cccc(C(=O)NC2CCN(C(=O)COc3ccccc3OC)CC2)c1
InChIInChI=1S/C22H26N2O5/c1-27-18-7-5-6-16(14-18)22(26)23-17-10-12-24(13-11-17)21(25)15-29-20-9-4-3-8-19(20)28-2/h3-9,14,17H,10-13,15H2,1-2H3,(H,23,26)
InChIKeyYQXJZXBCJJYWEI-UHFFFAOYSA-N
XLogP2.50
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[2-(2-ethoxyphenoxy)acetyl]piperidin-4-yl]-3,5-dimethoxybenzamide
CID 108550593
[3-[[1-[2-(2-ethoxyphenoxy)acetyl]piperidin-4-yl]carbamoyl]phenyl] acetate
CID 108548529
4-tert-butyl-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108554170
N-[1-[2-(2-tert-butyl-4-methylphenoxy)acetyl]piperidin-4-yl]-3-methoxybenzamide
CID 108550337
N-[1-[2-(2-ethoxyphenoxy)acetyl]piperidin-4-yl]-3-methylbenzamide
CID 108555351
3-methoxy-N-(1-pentanoylpiperidin-4-yl)benzamide
CID 110819514
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-3-methoxybenzamide
CID 110822246
2-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108557222
2,4-difluoro-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide
CID 108566626
2-(3,4-dimethylphenoxy)-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]acetamide
CID 108553023
2-methoxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108549181
2-ethyl-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]butanamide
CID 108555633

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide?
The IUPAC name of 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide (CID 108550372) is 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide.
What is the SMILES notation for 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide?
The canonical SMILES for 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide is COc1cccc(C(=O)NC2CCN(C(=O)COc3ccccc3OC)CC2)c1.
What is the InChIKey of 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide?
The InChIKey is YQXJZXBCJJYWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O5/c1-27-18-7-5-6-16(14-18)22(26)23-17-10-12-24(13-11-17)21(25)15-29-20-9-4-3-8-19(20)28-2/h3-9,14,17H,10-13,15H2,1-2H3,(H,23,26).
What are the key properties of 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide?
3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide has a molecular weight of 398.46 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[1-[2-(2-methoxyphenoxy)acetyl]piperidin-4-yl]benzamide is sourced from PubChem (CID 108550372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).