N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide

C18H19ClN2O3 — CID 108530380

IUPACN'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide
SMILESCCc1ccccc1NC(=O)C(=O)Nc1cc(C)c(Cl)cc1OC
InChIInChI=1S/C18H19ClN2O3/c1-4-12-7-5-6-8-14(12)20-17(22)18(23)21-15-9-11(2)13(19)10-16(15)24-3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyCXVNLIWUCRWSHZ-UHFFFAOYSA-N
MW346.81 g/mol
LogP3.80
Rot. Bonds4

About N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide

N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide (PubChem CID 108530380) has the molecular formula C18H19ClN2O3 and a molecular weight of 346.81 g/mol. Its IUPAC name is N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide.

Molecular Properties

Compound NameN'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide
PubChem CID108530380
Molecular FormulaC18H19ClN2O3
Molecular Weight346.81 g/mol
Exact Mass346.11
IUPAC NameN'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide
SMILESCCc1ccccc1NC(=O)C(=O)Nc1cc(C)c(Cl)cc1OC
InChIInChI=1S/C18H19ClN2O3/c1-4-12-7-5-6-8-14(12)20-17(22)18(23)21-15-9-11(2)13(19)10-16(15)24-3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyCXVNLIWUCRWSHZ-UHFFFAOYSA-N
XLogP3.80
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.81
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-N'-(4-chloro-2-methoxy-5-methylphenyl)oxamide
CID 108532266
N-(4-chloro-2-methoxy-5-methylphenyl)-N'-(2,6-dichlorophenyl)oxamide
CID 108532298
N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-cyanophenyl)oxamide
CID 108501670
5-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethylphenyl)pyrazine-2-carboxamide
CID 109291518
2-(4-chloro-2,5-dimethoxyanilino)-N-(2-ethylphenyl)acetamide
CID 109007659
N-(2,4-dimethoxyphenyl)-N'-(2-ethylphenyl)oxamide
CID 3220613
1-(4-chloro-2-methoxy-5-methylphenyl)-3-(3-chloro-2-methylphenyl)urea
CID 108991794
N-(4-chloro-2-methoxy-5-methylphenyl)-N'-methyl-N'-phenyloxamide
CID 108521016
1-(4-chloro-2-methoxy-5-methylphenyl)-3-(4-ethylphenyl)urea
CID 108991505
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide
CID 60680092
N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(4-fluorophenyl)oxamide
CID 108512659
N-(4-bromo-2-methylphenyl)-N'-(4-chloro-2-methoxy-5-methylphenyl)oxamide
CID 108532468

Frequently Asked Questions

What is the IUPAC name of N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide?
The IUPAC name of N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide (CID 108530380) is N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide.
What is the SMILES notation for N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide?
The canonical SMILES for N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide is CCc1ccccc1NC(=O)C(=O)Nc1cc(C)c(Cl)cc1OC.
What is the InChIKey of N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide?
The InChIKey is CXVNLIWUCRWSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O3/c1-4-12-7-5-6-8-14(12)20-17(22)18(23)21-15-9-11(2)13(19)10-16(15)24-3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide?
N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide has a molecular weight of 346.81 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-ethylphenyl)oxamide is sourced from PubChem (CID 108530380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).