2-[3-(2-phenylethoxy)anilino]benzamide

C21H20N2O2 — CID 56935695

IUPAC2-[3-(2-phenylethoxy)anilino]benzamide
SMILESNC(=O)c1ccccc1Nc1cccc(OCCc2ccccc2)c1
InChIInChI=1S/C21H20N2O2/c22-21(24)19-11-4-5-12-20(19)23-17-9-6-10-18(15-17)25-14-13-16-7-2-1-3-8-16/h1-12,15,23H,13-14H2,(H2,22,24)
InChIKeyVVRUXFPJOVUDCV-UHFFFAOYSA-N
MW332.40 g/mol
LogP4.15
Rot. Bonds7

About 2-[3-(2-phenylethoxy)anilino]benzamide

2-[3-(2-phenylethoxy)anilino]benzamide (PubChem CID 56935695) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-[3-(2-phenylethoxy)anilino]benzamide.

Molecular Properties

Compound Name2-[3-(2-phenylethoxy)anilino]benzamide
PubChem CID56935695
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC Name2-[3-(2-phenylethoxy)anilino]benzamide
SMILESNC(=O)c1ccccc1Nc1cccc(OCCc2ccccc2)c1
InChIInChI=1S/C21H20N2O2/c22-21(24)19-11-4-5-12-20(19)23-17-9-6-10-18(15-17)25-14-13-16-7-2-1-3-8-16/h1-12,15,23H,13-14H2,(H2,22,24)
InChIKeyVVRUXFPJOVUDCV-UHFFFAOYSA-N
XLogP4.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-phenylethoxy)anilino]benzamide?
The IUPAC name of 2-[3-(2-phenylethoxy)anilino]benzamide (CID 56935695) is 2-[3-(2-phenylethoxy)anilino]benzamide.
What is the SMILES notation for 2-[3-(2-phenylethoxy)anilino]benzamide?
The canonical SMILES for 2-[3-(2-phenylethoxy)anilino]benzamide is NC(=O)c1ccccc1Nc1cccc(OCCc2ccccc2)c1.
What is the InChIKey of 2-[3-(2-phenylethoxy)anilino]benzamide?
The InChIKey is VVRUXFPJOVUDCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c22-21(24)19-11-4-5-12-20(19)23-17-9-6-10-18(15-17)25-14-13-16-7-2-1-3-8-16/h1-12,15,23H,13-14H2,(H2,22,24).
What are the key properties of 2-[3-(2-phenylethoxy)anilino]benzamide?
2-[3-(2-phenylethoxy)anilino]benzamide has a molecular weight of 332.40 g/mol, XLogP of 4.15, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-phenylethoxy)anilino]benzamide is sourced from PubChem (CID 56935695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).