N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide

C16H14Cl2N2O2 — CID 108500732

IUPACN-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide
SMILESCCN(C(=O)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1
InChIInChI=1S/C16H14Cl2N2O2/c1-2-20(11-7-4-3-5-8-11)16(22)15(21)19-13-10-6-9-12(17)14(13)18/h3-10H,2H2,1H3,(H,19,21)
InChIKeyFWMHNEFTWORERH-UHFFFAOYSA-N
MW337.21 g/mol
LogP3.98
Rot. Bonds3

About N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide

N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide (PubChem CID 108500732) has the molecular formula C16H14Cl2N2O2 and a molecular weight of 337.21 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide
PubChem CID108500732
Molecular FormulaC16H14Cl2N2O2
Molecular Weight337.21 g/mol
Exact Mass336.04
IUPAC NameN-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide
SMILESCCN(C(=O)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1
InChIInChI=1S/C16H14Cl2N2O2/c1-2-20(11-7-4-3-5-8-11)16(22)15(21)19-13-10-6-9-12(17)14(13)18/h3-10H,2H2,1H3,(H,19,21)
InChIKeyFWMHNEFTWORERH-UHFFFAOYSA-N
XLogP3.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.21
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

3-(2,3-dichlorophenyl)-1-ethyl-1-phenylurea
CID 108991555
N-(2,3-dichlorophenyl)-2-(N-ethylanilino)acetamide
CID 54808631
N-(3-chlorophenyl)-N'-ethyl-N'-phenyloxamide
CID 108516466
N',N'-dibenzyl-N-(2,3-dichlorophenyl)oxamide
CID 108500761
N-(2,6-difluorophenyl)-N'-ethyl-N'-phenyloxamide
CID 108518572
N'-ethyl-N'-phenyl-N-(2-phenylsulfanylphenyl)oxamide
CID 108515113
3-(2,3-dichlorophenyl)-1,1-diethylurea
CID 4098247
N-[4-chloro-2-(trifluoromethyl)phenyl]-N'-ethyl-N'-phenyloxamide
CID 108518687
N-(2,3-dichlorophenyl)-N'-methyl-N'-phenylpropanediamide
CID 108953239
N-[4-(diethylamino)-2-methylphenyl]-N'-ethyl-N'-phenyloxamide
CID 108518693
3-(2,3-dichlorophenyl)-1-phenyl-1-propan-2-ylurea
CID 3539470
1-(2,3-dichlorophenyl)-3-(2-ethylphenyl)urea
CID 108991483

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide (CID 108500732) is N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide is CCN(C(=O)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide?
The InChIKey is FWMHNEFTWORERH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O2/c1-2-20(11-7-4-3-5-8-11)16(22)15(21)19-13-10-6-9-12(17)14(13)18/h3-10H,2H2,1H3,(H,19,21).
What are the key properties of N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide?
N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide has a molecular weight of 337.21 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-N'-ethyl-N'-phenyloxamide is sourced from PubChem (CID 108500732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).