2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride

C16H23ClN2O3 — CID 119385762

IUPAC2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride
SMILESCOc1ccc(C(C)=O)cc1CC(=O)NC1CCNCC1.Cl
InChIInChI=1S/C16H22N2O3.ClH/c1-11(19)12-3-4-15(21-2)13(9-12)10-16(20)18-14-5-7-17-8-6-14;/h3-4,9,14,17H,5-8,10H2,1-2H3,(H,18,20);1H
InChIKeyPOPWAFXAMFQNPJ-UHFFFAOYSA-N
MW326.82 g/mol
LogP1.73
Rot. Bonds5

About 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride

2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride (PubChem CID 119385762) has the molecular formula C16H23ClN2O3 and a molecular weight of 326.82 g/mol. Its IUPAC name is 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride
PubChem CID119385762
Molecular FormulaC16H23ClN2O3
Molecular Weight326.82 g/mol
Exact Mass326.14
IUPAC Name2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride
SMILESCOc1ccc(C(C)=O)cc1CC(=O)NC1CCNCC1.Cl
InChIInChI=1S/C16H22N2O3.ClH/c1-11(19)12-3-4-15(21-2)13(9-12)10-16(20)18-14-5-7-17-8-6-14;/h3-4,9,14,17H,5-8,10H2,1-2H3,(H,18,20);1H
InChIKeyPOPWAFXAMFQNPJ-UHFFFAOYSA-N
XLogP1.73
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.82
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-bromo-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119387893
4-(4-acetyl-2-methoxyphenoxy)-N-piperidin-4-ylbutanamide;hydrochloride
CID 119388425
2-(5-acetyl-2-methoxyphenyl)-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
CID 18117011
2-(5-acetyl-2-methoxyphenyl)-N-(1-propylpiperidin-4-yl)acetamide
CID 78809941
1-[4-methoxy-3-[[methyl(piperidin-4-yl)amino]methyl]phenyl]ethanone
CID 43607598
2-(5-acetyl-2-methoxyphenyl)-N-[3-(trifluoromethyl)cyclohexyl]acetamide
CID 18147803
3-hydroxy-4-methoxy-N-piperidin-4-ylbenzamide
CID 79725951
2-(4-acetyl-2-methoxyphenoxy)-N-cyclooctylacetamide
CID 7962262
2-(5-acetyl-2-methoxyphenyl)acetic acid
CID 2535148
1-[4-methoxy-3-(piperazin-1-ylmethyl)phenyl]ethanone
CID 43237144
2-(5-acetyl-2-methoxyphenyl)-N-(2-amino-1-cyclopropylethyl)acetamide
CID 119612751
N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride?
The IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride (CID 119385762) is 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride.
What is the SMILES notation for 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride?
The canonical SMILES for 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride is COc1ccc(C(C)=O)cc1CC(=O)NC1CCNCC1.Cl.
What is the InChIKey of 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride?
The InChIKey is POPWAFXAMFQNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3.ClH/c1-11(19)12-3-4-15(21-2)13(9-12)10-16(20)18-14-5-7-17-8-6-14;/h3-4,9,14,17H,5-8,10H2,1-2H3,(H,18,20);1H.
What are the key properties of 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride?
2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride has a molecular weight of 326.82 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2-methoxyphenyl)-N-piperidin-4-ylacetamide;hydrochloride is sourced from PubChem (CID 119385762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).