2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide

C21H19ClN2O2 — CID 108998186

IUPAC2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide
SMILESO=C(CNCc1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C21H19ClN2O2/c22-17-12-10-16(11-13-17)14-23-15-21(25)24-19-8-4-5-9-20(19)26-18-6-2-1-3-7-18/h1-13,23H,14-15H2,(H,24,25)
InChIKeyRDSJBAGCSVQWMK-UHFFFAOYSA-N
MW366.85 g/mol
LogP4.86
Rot. Bonds7

About 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide

2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide (PubChem CID 108998186) has the molecular formula C21H19ClN2O2 and a molecular weight of 366.85 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide
PubChem CID108998186
Molecular FormulaC21H19ClN2O2
Molecular Weight366.85 g/mol
Exact Mass366.11
IUPAC Name2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide
SMILESO=C(CNCc1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C21H19ClN2O2/c22-17-12-10-16(11-13-17)14-23-15-21(25)24-19-8-4-5-9-20(19)26-18-6-2-1-3-7-18/h1-13,23H,14-15H2,(H,24,25)
InChIKeyRDSJBAGCSVQWMK-UHFFFAOYSA-N
XLogP4.86
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.85
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)propanamide
CID 109021922
2-[(2-fluorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide
CID 108997601
2-(2-chloroanilino)-N-(2-phenoxyphenyl)acetamide
CID 9098717
N-(2-phenoxyphenyl)-2-(prop-2-enylamino)acetamide
CID 78908251
N-(2-phenoxyphenyl)-2-phenylacetamide
CID 1121260
2-(pentylamino)-N-(2-phenoxyphenyl)acetamide
CID 109006006
N-(2-phenoxyphenyl)-3-(pyridin-4-ylmethylamino)propanamide
CID 109024062
N-(5-chloro-2-methoxyphenyl)-2-[(4-chlorophenyl)methylamino]acetamide
CID 108998151
2-[(4-hydroxyphenyl)methylamino]-N-(2-methoxyphenyl)acetamide
CID 114331761
2-(4-chlorophenoxy)-N-[2-(4-methylphenoxy)phenyl]acetamide
CID 7925670
2-(4-ethylanilino)-N-(2-phenoxyphenyl)acetamide
CID 109007685
N-(2-methoxyphenyl)-2-(2-phenoxyanilino)acetamide
CID 7922855

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide (CID 108998186) is 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide is O=C(CNCc1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide?
The InChIKey is RDSJBAGCSVQWMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O2/c22-17-12-10-16(11-13-17)14-23-15-21(25)24-19-8-4-5-9-20(19)26-18-6-2-1-3-7-18/h1-13,23H,14-15H2,(H,24,25).
What are the key properties of 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide?
2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide has a molecular weight of 366.85 g/mol, XLogP of 4.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methylamino]-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 108998186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).