2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide

C15H13ClN2O3 — CID 3481891

IUPAC2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C15H13ClN2O3/c16-11-6-2-3-7-12(11)18-14(19)9-21-13-8-4-1-5-10(13)15(17)20/h1-8H,9H2,(H2,17,20)(H,18,19)
InChIKeyKOMIXBSZUDSDJX-UHFFFAOYSA-N
MW304.73 g/mol
LogP2.46
Rot. Bonds5

About 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide

2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide (PubChem CID 3481891) has the molecular formula C15H13ClN2O3 and a molecular weight of 304.73 g/mol. Its IUPAC name is 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide
PubChem CID3481891
Molecular FormulaC15H13ClN2O3
Molecular Weight304.73 g/mol
Exact Mass304.06
IUPAC Name2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)Nc1ccccc1Cl
InChIInChI=1S/C15H13ClN2O3/c16-11-6-2-3-7-12(11)18-14(19)9-21-13-8-4-1-5-10(13)15(17)20/h1-8H,9H2,(H2,17,20)(H,18,19)
InChIKeyKOMIXBSZUDSDJX-UHFFFAOYSA-N
XLogP2.46
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.73
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
CID 9085660
2-(2-chlorophenoxy)-N-[2-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]acetamide
CID 1032604
2-[2-[2-(difluoromethoxy)anilino]-2-oxoethoxy]benzamide
CID 7278808
2-[2-(2-nitroanilino)-2-oxoethoxy]benzamide
CID 38858639
2-[[2-(2-methylphenoxy)acetyl]amino]benzamide
CID 4268113
N-(2-acetylphenyl)-2-(2-chlorophenoxy)acetamide
CID 2707164
2-[2-[(1S)-1-aminoethyl]phenoxy]-N-(2-chlorophenyl)acetamide
CID 78930426
N-(2-chlorophenyl)-2-(2-trimethylsilyloxyphenoxy)acetamide
CID 91696728
2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
2-[2-(4-fluoroanilino)-2-oxoethoxy]benzamide
CID 7283884
4-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-N-(2-chlorophenyl)-4-oxobutanamide
CID 3394735

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide (CID 3481891) is 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide is NC(=O)c1ccccc1OCC(=O)Nc1ccccc1Cl.
What is the InChIKey of 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide?
The InChIKey is KOMIXBSZUDSDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O3/c16-11-6-2-3-7-12(11)18-14(19)9-21-13-8-4-1-5-10(13)15(17)20/h1-8H,9H2,(H2,17,20)(H,18,19).
What are the key properties of 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide?
2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide has a molecular weight of 304.73 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 3481891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).