1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

C24H28N2O6 — CID 33335967

IUPAC1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(C(=O)COc2ccc(C(C)=O)cc2OC)CC1
InChIInChI=1S/C24H28N2O6/c1-16(27)18-8-9-21(22(14-18)31-3)32-15-23(28)26-12-10-17(11-13-26)24(29)25-19-6-4-5-7-20(19)30-2/h4-9,14,17H,10-13,15H2,1-3H3,(H,25,29)
InChIKeyVFJSRRAQCXJKMV-UHFFFAOYSA-N
MW440.50 g/mol
LogP3.16
Rot. Bonds8

About 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide (PubChem CID 33335967) has the molecular formula C24H28N2O6 and a molecular weight of 440.50 g/mol. Its IUPAC name is 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
PubChem CID33335967
Molecular FormulaC24H28N2O6
Molecular Weight440.50 g/mol
Exact Mass440.19
IUPAC Name1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(C(=O)COc2ccc(C(C)=O)cc2OC)CC1
InChIInChI=1S/C24H28N2O6/c1-16(27)18-8-9-21(22(14-18)31-3)32-15-23(28)26-12-10-17(11-13-26)24(29)25-19-6-4-5-7-20(19)30-2/h4-9,14,17H,10-13,15H2,1-3H3,(H,25,29)
InChIKeyVFJSRRAQCXJKMV-UHFFFAOYSA-N
XLogP3.16
TPSA94.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.50
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-acetyl-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 6468496
1-(3,5-dimethoxy-4-methylbenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 33336070
N-cyclopropyl-1-[2-(2-methoxyphenoxy)acetyl]piperidine-4-carboxamide
CID 113002547
1-(3,3-diphenylpropanoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 38646196
N-(2-methoxyphenyl)-1-[2-(trifluoromethylsulfanyl)acetyl]piperidine-4-carboxamide
CID 38644491
N-(2-methoxyphenyl)-1-[2-(4-methylphenyl)acetyl]piperidine-4-carboxamide
CID 38645839
N-(2-methoxyphenyl)-1-[2-(4-methoxyphenyl)acetyl]piperidine-4-carboxamide
CID 33344202
N-(2-methoxyphenyl)-1-octanoylpiperidine-4-carboxamide
CID 55653511
1-(2,2-dimethylpropanoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17224335
1-(4-chlorobenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 2295609
1-[2-(4-cyano-2-methoxyphenoxy)acetyl]-N-pyridin-2-ylpiperidine-4-carboxamide
CID 55808382
1-N,1-N-diethyl-4-N-(2-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 56922674

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide (CID 33335967) is 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide is COc1ccccc1NC(=O)C1CCN(C(=O)COc2ccc(C(C)=O)cc2OC)CC1.
What is the InChIKey of 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
The InChIKey is VFJSRRAQCXJKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O6/c1-16(27)18-8-9-21(22(14-18)31-3)32-15-23(28)26-12-10-17(11-13-26)24(29)25-19-6-4-5-7-20(19)30-2/h4-9,14,17H,10-13,15H2,1-3H3,(H,25,29).
What are the key properties of 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide?
1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide has a molecular weight of 440.50 g/mol, XLogP of 3.16, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-acetyl-2-methoxyphenoxy)acetyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 33335967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).