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

C18H22N4O2 — CID 5055611

IUPACN-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCN(c2ccccn2)CC1
InChIInChI=1S/C18H22N4O2/c1-24-16-7-3-2-6-15(16)20-18(23)14-21-10-12-22(13-11-21)17-8-4-5-9-19-17/h2-9H,10-14H2,1H3,(H,20,23)
InChIKeyDGDPIUHYQDINOZ-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.85
Rot. Bonds5

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

N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (PubChem CID 5055611) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
PubChem CID5055611
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESCOc1ccccc1NC(=O)CN1CCN(c2ccccn2)CC1
InChIInChI=1S/C18H22N4O2/c1-24-16-7-3-2-6-15(16)20-18(23)14-21-10-12-22(13-11-21)17-8-4-5-9-19-17/h2-9H,10-14H2,1H3,(H,20,23)
InChIKeyDGDPIUHYQDINOZ-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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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (CID 5055611) is N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is COc1ccccc1NC(=O)CN1CCN(c2ccccn2)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The InChIKey is DGDPIUHYQDINOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-24-16-7-3-2-6-15(16)20-18(23)14-21-10-12-22(13-11-21)17-8-4-5-9-19-17/h2-9H,10-14H2,1H3,(H,20,23).
What are the key properties of N-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
N-(2-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-(2-methoxyphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 5055611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).