N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride

C14H23Cl2N3O3 — CID 56773506

IUPACN-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride
SMILESCOc1ccc(OC)c(NC(=O)CN2CCNCC2)c1.Cl.Cl
InChIInChI=1S/C14H21N3O3.2ClH/c1-19-11-3-4-13(20-2)12(9-11)16-14(18)10-17-7-5-15-6-8-17;;/h3-4,9,15H,5-8,10H2,1-2H3,(H,16,18);2*1H
InChIKeyMOEGGMXNJBBWCY-UHFFFAOYSA-N
MW352.26 g/mol
LogP1.39
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride

N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride (PubChem CID 56773506) has the molecular formula C14H23Cl2N3O3 and a molecular weight of 352.26 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride
PubChem CID56773506
Molecular FormulaC14H23Cl2N3O3
Molecular Weight352.26 g/mol
Exact Mass351.11
IUPAC NameN-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride
SMILESCOc1ccc(OC)c(NC(=O)CN2CCNCC2)c1.Cl.Cl
InChIInChI=1S/C14H21N3O3.2ClH/c1-19-11-3-4-13(20-2)12(9-11)16-14(18)10-17-7-5-15-6-8-17;;/h3-4,9,15H,5-8,10H2,1-2H3,(H,16,18);2*1H
InChIKeyMOEGGMXNJBBWCY-UHFFFAOYSA-N
XLogP1.39
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.26
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;hydrochloride
CID 132785417
2-(1,4-diazepan-1-yl)-N-(2,5-dimethoxyphenyl)acetamide;hydrochloride
CID 119906303
N-(2,5-dimethoxyphenyl)-2-pyrrolidin-1-ylacetamide
CID 8901780
2-(1,4-diazepan-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide;hydrochloride
CID 119906331
N-(2,5-dimethoxyphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919183
N-(2,5-dimethoxyphenyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
CID 2653031
N-(2,5-dimethoxyphenyl)-2-[2-(2-methoxyphenyl)piperazin-1-yl]acetamide
CID 120753359
N-(2,5-dimethoxyphenyl)-2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]acetamide
CID 6469646
1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134267
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
N-(2,5-dimethoxyphenyl)-2-[4-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]piperazin-1-yl]acetamide
CID 36897882
N-(2,5-dimethoxyphenyl)-3-piperidin-4-ylpropanamide
CID 62210492

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride (CID 56773506) is N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride is COc1ccc(OC)c(NC(=O)CN2CCNCC2)c1.Cl.Cl.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride?
The InChIKey is MOEGGMXNJBBWCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3.2ClH/c1-19-11-3-4-13(20-2)12(9-11)16-14(18)10-17-7-5-15-6-8-17;;/h3-4,9,15H,5-8,10H2,1-2H3,(H,16,18);2*1H.
What are the key properties of N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride?
N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride has a molecular weight of 352.26 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-piperazin-1-ylacetamide;dihydrochloride is sourced from PubChem (CID 56773506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).