N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide

C18H22N4O2 — CID 5014292

IUPACN-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESCOc1cccc(NC(=O)CN2CCN(c3ccccn3)CC2)c1
InChIInChI=1S/C18H22N4O2/c1-24-16-6-4-5-15(13-16)20-18(23)14-21-9-11-22(12-10-21)17-7-2-3-8-19-17/h2-8,13H,9-12,14H2,1H3,(H,20,23)
InChIKeyOSRBZJLMAASEPJ-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.85
Rot. Bonds5

About N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide

N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (PubChem CID 5014292) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
PubChem CID5014292
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESCOc1cccc(NC(=O)CN2CCN(c3ccccn3)CC2)c1
InChIInChI=1S/C18H22N4O2/c1-24-16-6-4-5-15(13-16)20-18(23)14-21-9-11-22(12-10-21)17-7-2-3-8-19-17/h2-8,13H,9-12,14H2,1H3,(H,20,23)
InChIKeyOSRBZJLMAASEPJ-UHFFFAOYSA-N
XLogP1.85
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,5-dimethoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 15995513
N-(3-methoxyphenyl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide
CID 18167873
N-(3-methoxyphenyl)-3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide
CID 108950907
N-(3-methylsulfonylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 8618487
2-[4-[6-(4,4-difluoropiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]-N-(3-methoxyphenyl)acetamide
CID 172882295
N-(4,6-dimethoxypyrimidin-2-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 17496713
N-(3-methoxyphenyl)-2-(4-methylpiperazin-1-yl)acetamide;hydrochloride
CID 2958479
N-(4-methoxy-2-nitrophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4818554
2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
CID 8583685
N-(3-fluoro-4-methylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 4566699
N-(4-fluorophenyl)-2-[4-[2-(3-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 7336695
N-(3-methoxyphenyl)-2-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]acetamide
CID 127036821

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (CID 5014292) is N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is COc1cccc(NC(=O)CN2CCN(c3ccccn3)CC2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The InChIKey is OSRBZJLMAASEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-24-16-6-4-5-15(13-16)20-18(23)14-21-9-11-22(12-10-21)17-7-2-3-8-19-17/h2-8,13H,9-12,14H2,1H3,(H,20,23).
What are the key properties of N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 5014292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).