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

C17H20N4O — CID 4780744

IUPACN-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1
InChIInChI=1S/C17H20N4O/c22-17(19-15-6-2-1-3-7-15)14-20-10-12-21(13-11-20)16-8-4-5-9-18-16/h1-9H,10-14H2,(H,19,22)
InChIKeyFVNXUDNXRWMPSG-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.84
Rot. Bonds4

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

N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (PubChem CID 4780744) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
PubChem CID4780744
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
SMILESO=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1
InChIInChI=1S/C17H20N4O/c22-17(19-15-6-2-1-3-7-15)14-20-10-12-21(13-11-20)16-8-4-5-9-18-16/h1-9H,10-14H2,(H,19,22)
InChIKeyFVNXUDNXRWMPSG-UHFFFAOYSA-N
XLogP1.84
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The IUPAC name of N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide (CID 4780744) is N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The canonical SMILES for N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is O=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1.
What is the InChIKey of N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
The InChIKey is FVNXUDNXRWMPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(19-15-6-2-1-3-7-15)14-20-10-12-21(13-11-20)16-8-4-5-9-18-16/h1-9H,10-14H2,(H,19,22).
What are the key properties of N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide?
N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide has a molecular weight of 296.37 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide is sourced from PubChem (CID 4780744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).