2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide

C19H21N3O3 — CID 25218485

IUPAC2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide
SMILESNC(=O)c1ccccc1OCc1cccc(C(=O)N2CCNCC2)c1
InChIInChI=1S/C19H21N3O3/c20-18(23)16-6-1-2-7-17(16)25-13-14-4-3-5-15(12-14)19(24)22-10-8-21-9-11-22/h1-7,12,21H,8-11,13H2,(H2,20,23)
InChIKeyUKDWVGYGPSCEBE-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.41
Rot. Bonds5

About 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide

2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide (PubChem CID 25218485) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide.

Molecular Properties

Compound Name2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide
PubChem CID25218485
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide
SMILESNC(=O)c1ccccc1OCc1cccc(C(=O)N2CCNCC2)c1
InChIInChI=1S/C19H21N3O3/c20-18(23)16-6-1-2-7-17(16)25-13-14-4-3-5-15(12-14)19(24)22-10-8-21-9-11-22/h1-7,12,21H,8-11,13H2,(H2,20,23)
InChIKeyUKDWVGYGPSCEBE-UHFFFAOYSA-N
XLogP1.41
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide?
The IUPAC name of 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide (CID 25218485) is 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide.
What is the SMILES notation for 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide?
The canonical SMILES for 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide is NC(=O)c1ccccc1OCc1cccc(C(=O)N2CCNCC2)c1.
What is the InChIKey of 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide?
The InChIKey is UKDWVGYGPSCEBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c20-18(23)16-6-1-2-7-17(16)25-13-14-4-3-5-15(12-14)19(24)22-10-8-21-9-11-22/h1-7,12,21H,8-11,13H2,(H2,20,23).
What are the key properties of 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide?
2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide has a molecular weight of 339.40 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(piperazine-1-carbonyl)phenyl]methoxy]benzamide is sourced from PubChem (CID 25218485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).