2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide

C16H15ClN2O3 — CID 35270563

IUPAC2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide
SMILESO=C(COCC(=O)Nc1ccc(Cl)cc1)Nc1ccccc1
InChIInChI=1S/C16H15ClN2O3/c17-12-6-8-14(9-7-12)19-16(21)11-22-10-15(20)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,19,21)
InChIKeyKTVCDOZMRJKIOL-UHFFFAOYSA-N
MW318.76 g/mol
LogP2.93
Rot. Bonds6

About 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide

2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide (PubChem CID 35270563) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide
PubChem CID35270563
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide
SMILESO=C(COCC(=O)Nc1ccc(Cl)cc1)Nc1ccccc1
InChIInChI=1S/C16H15ClN2O3/c17-12-6-8-14(9-7-12)19-16(21)11-22-10-15(20)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,19,21)
InChIKeyKTVCDOZMRJKIOL-UHFFFAOYSA-N
XLogP2.93
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(4-chloroanilino)-2-oxoethyl] 4-(phenylcarbamoylamino)benzoate
CID 19059171
N-phenyl-2-phenylmethoxyacetamide
CID 15220156
2-[(4-chlorophenyl)methylideneamino]oxy-N-phenylacetamide
CID 2430181
N-(4-chlorophenyl)-2-(2-phenylphenoxy)acetamide
CID 7894368
N-(4-chlorophenyl)-2-[(2-phenylmethoxyacetyl)amino]benzamide
CID 55466370
N-[4-[(4-chlorophenyl)methylamino]phenyl]-2-phenoxyacetamide
CID 112982593
(2-anilino-2-oxoethyl) (E)-3-(4-chlorophenyl)prop-2-enoate
CID 2343081
N-[4-(4-chloroanilino)phenyl]-2-phenylacetamide
CID 112987026
2-[2,6-dibromo-4-[(4-chloroanilino)methyl]phenoxy]-N-phenylacetamide
CID 126274300
2-[(4-chlorophenyl)carbamothioylamino]-N-phenylacetamide
CID 87893882
2-(2-benzylphenoxy)-N-(4-chlorophenyl)acetamide
CID 7900618
[2-(4-chloroanilino)-2-oxoethyl] 1-phenylcyclopropane-1-carboxylate
CID 8588474

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide?
The IUPAC name of 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide (CID 35270563) is 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide?
The canonical SMILES for 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide is O=C(COCC(=O)Nc1ccc(Cl)cc1)Nc1ccccc1.
What is the InChIKey of 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide?
The InChIKey is KTVCDOZMRJKIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c17-12-6-8-14(9-7-12)19-16(21)11-22-10-15(20)18-13-4-2-1-3-5-13/h1-9H,10-11H2,(H,18,20)(H,19,21).
What are the key properties of 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide?
2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide has a molecular weight of 318.76 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chloroanilino)-2-oxoethoxy]-N-phenylacetamide is sourced from PubChem (CID 35270563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).