2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide

C22H20N2O3 — CID 4800998

IUPAC2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide
SMILESO=C(COc1ccccc1C(=O)NCc1ccccc1)Nc1ccccc1
InChIInChI=1S/C22H20N2O3/c25-21(24-18-11-5-2-6-12-18)16-27-20-14-8-7-13-19(20)22(26)23-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,26)(H,24,25)
InChIKeyYPFJRJDVRGNFFB-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.63
Rot. Bonds7

About 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide

2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide (PubChem CID 4800998) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide.

Molecular Properties

Compound Name2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide
PubChem CID4800998
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide
SMILESO=C(COc1ccccc1C(=O)NCc1ccccc1)Nc1ccccc1
InChIInChI=1S/C22H20N2O3/c25-21(24-18-11-5-2-6-12-18)16-27-20-14-8-7-13-19(20)22(26)23-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,26)(H,24,25)
InChIKeyYPFJRJDVRGNFFB-UHFFFAOYSA-N
XLogP3.63
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide?
The IUPAC name of 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide (CID 4800998) is 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide.
What is the SMILES notation for 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide?
The canonical SMILES for 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide is O=C(COc1ccccc1C(=O)NCc1ccccc1)Nc1ccccc1.
What is the InChIKey of 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide?
The InChIKey is YPFJRJDVRGNFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O3/c25-21(24-18-11-5-2-6-12-18)16-27-20-14-8-7-13-19(20)22(26)23-15-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,23,26)(H,24,25).
What are the key properties of 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide?
2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide has a molecular weight of 360.41 g/mol, XLogP of 3.63, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide is sourced from PubChem (CID 4800998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).