N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide

C17H16Cl2N2O5 — CID 108502302

IUPACN-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
SMILESCOc1cc(NC(=O)C(=O)Nc2cc(Cl)ccc2OC)c(OC)cc1Cl
InChIInChI=1S/C17H16Cl2N2O5/c1-24-13-5-4-9(18)6-11(13)20-16(22)17(23)21-12-8-14(25-2)10(19)7-15(12)26-3/h4-8H,1-3H3,(H,20,22)(H,21,23)
InChIKeyOGBGHVNCYQWIAE-UHFFFAOYSA-N
MW399.23 g/mol
LogP3.60
Rot. Bonds5

About N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide

N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide (PubChem CID 108502302) has the molecular formula C17H16Cl2N2O5 and a molecular weight of 399.23 g/mol. Its IUPAC name is N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
PubChem CID108502302
Molecular FormulaC17H16Cl2N2O5
Molecular Weight399.23 g/mol
Exact Mass398.04
IUPAC NameN-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
SMILESCOc1cc(NC(=O)C(=O)Nc2cc(Cl)ccc2OC)c(OC)cc1Cl
InChIInChI=1S/C17H16Cl2N2O5/c1-24-13-5-4-9(18)6-11(13)20-16(22)17(23)21-12-8-14(25-2)10(19)7-15(12)26-3/h4-8H,1-3H3,(H,20,22)(H,21,23)
InChIKeyOGBGHVNCYQWIAE-UHFFFAOYSA-N
XLogP3.60
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.23
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-2,5-dimethoxyphenyl)-2-(5-chloro-2-methoxyanilino)acetamide
CID 42026368
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(2,5-difluorophenyl)oxamide
CID 108532288
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(4-chloro-2-methoxy-5-methylphenyl)oxamide
CID 108532266
2-(5-chloro-2-methoxyanilino)-2-oxoacetate
CID 2300901
N'-(5-chloro-2-methoxyphenyl)-N-cyclopropyloxamide
CID 2194402
N'-(5-chloro-2-methoxyphenyl)-N-(3,4-dimethoxyphenyl)oxamide
CID 45000696
N'-(4-chloro-2,5-dimethoxyphenyl)-N-(2-hydroxyphenyl)oxamide
CID 108514378
N'-tert-butyl-N-(4-chloro-2,5-dimethoxyphenyl)oxamide
CID 108506924
N-(5-chloro-2-methoxyphenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108502213
N'-(5-chloro-2-methoxyphenyl)-N-(2,4-difluorophenyl)oxamide
CID 108502324
N-(4-amino-3-chlorophenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
CID 108502189
N-(4-chloro-2-methoxy-5-methylphenyl)-N'-(5-chloro-2-methoxyphenyl)propanediamide
CID 108955473

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide?
The IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide (CID 108502302) is N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide.
What is the SMILES notation for N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide?
The canonical SMILES for N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide is COc1cc(NC(=O)C(=O)Nc2cc(Cl)ccc2OC)c(OC)cc1Cl.
What is the InChIKey of N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide?
The InChIKey is OGBGHVNCYQWIAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O5/c1-24-13-5-4-9(18)6-11(13)20-16(22)17(23)21-12-8-14(25-2)10(19)7-15(12)26-3/h4-8H,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide?
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide has a molecular weight of 399.23 g/mol, XLogP of 3.60, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide is sourced from PubChem (CID 108502302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).