N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide

C16H20N6O2 — CID 169225231

IUPACN-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCN(c3ncccn3)CC2)cn1
InChIInChI=1S/C16H20N6O2/c1-24-15-4-3-13(11-19-15)20-14(23)12-21-7-9-22(10-8-21)16-17-5-2-6-18-16/h2-6,11H,7-10,12H2,1H3,(H,20,23)
InChIKeyGGFRCIIAJAUGTK-UHFFFAOYSA-N
MW328.38 g/mol
LogP0.64
Rot. Bonds5

About N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide

N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide (PubChem CID 169225231) has the molecular formula C16H20N6O2 and a molecular weight of 328.38 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
PubChem CID169225231
Molecular FormulaC16H20N6O2
Molecular Weight328.38 g/mol
Exact Mass328.16
IUPAC NameN-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCN(c3ncccn3)CC2)cn1
InChIInChI=1S/C16H20N6O2/c1-24-15-4-3-13(11-19-15)20-14(23)12-21-7-9-22(10-8-21)16-17-5-2-6-18-16/h2-6,11H,7-10,12H2,1H3,(H,20,23)
InChIKeyGGFRCIIAJAUGTK-UHFFFAOYSA-N
XLogP0.64
TPSA83.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide (CID 169225231) is N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide is COc1ccc(NC(=O)CN2CCN(c3ncccn3)CC2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide?
The InChIKey is GGFRCIIAJAUGTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2/c1-24-15-4-3-13(11-19-15)20-14(23)12-21-7-9-22(10-8-21)16-17-5-2-6-18-16/h2-6,11H,7-10,12H2,1H3,(H,20,23).
What are the key properties of N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide?
N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide has a molecular weight of 328.38 g/mol, XLogP of 0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 169225231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).