3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide

C17H16Cl2N2O2 — CID 27762230

IUPAC3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
SMILESCCc1ccccc1NC(=O)CNC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H16Cl2N2O2/c1-2-11-5-3-4-6-15(11)21-16(22)10-20-17(23)12-7-13(18)9-14(19)8-12/h3-9H,2,10H2,1H3,(H,20,23)(H,21,22)
InChIKeySEVIEYVYBKVNKK-UHFFFAOYSA-N
MW351.23 g/mol
LogP3.92
Rot. Bonds5

About 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide

3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide (PubChem CID 27762230) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
PubChem CID27762230
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC Name3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
SMILESCCc1ccccc1NC(=O)CNC(=O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C17H16Cl2N2O2/c1-2-11-5-3-4-6-15(11)21-16(22)10-20-17(23)12-7-13(18)9-14(19)8-12/h3-9H,2,10H2,1H3,(H,20,23)(H,21,22)
InChIKeySEVIEYVYBKVNKK-UHFFFAOYSA-N
XLogP3.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide
CID 8699091
4-ethyl-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 26678506
N-[2-(2-ethylanilino)-2-oxoethyl]naphthalene-2-carboxamide
CID 8699030
3-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-4,5-dimethoxybenzamide
CID 40730715
4-bromo-N-[2-(2-ethylanilino)-2-oxoethyl]-3,5-dimethoxybenzamide
CID 26707249
4-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylsulfonylbenzamide
CID 26678437
4-(carbamoylamino)-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 26076497
2-(5-chloro-2-methoxyphenyl)-N-[2-(2-ethylanilino)-2-oxoethyl]acetamide
CID 9090821
3,5-dichloro-N-[2-(ethylaminomethyl)phenyl]benzamide
CID 43601335
4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 26905200
1-(3,5-dichlorophenyl)-3-(2-ethylphenyl)urea
CID 108991481
N-[2-(2-ethylanilino)-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide
CID 27762316

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide?
The IUPAC name of 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide (CID 27762230) is 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide?
The canonical SMILES for 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide is CCc1ccccc1NC(=O)CNC(=O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide?
The InChIKey is SEVIEYVYBKVNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-2-11-5-3-4-6-15(11)21-16(22)10-20-17(23)12-7-13(18)9-14(19)8-12/h3-9H,2,10H2,1H3,(H,20,23)(H,21,22).
What are the key properties of 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide?
3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide has a molecular weight of 351.23 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 27762230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).