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

C17H18ClN3O4 — CID 108532284

IUPACN'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide
SMILESCOc1cc(NC(=O)C(=O)Nc2cc(C)ccc2N)c(OC)cc1Cl
InChIInChI=1S/C17H18ClN3O4/c1-9-4-5-11(19)12(6-9)20-16(22)17(23)21-13-8-14(24-2)10(18)7-15(13)25-3/h4-8H,19H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyDFPICFNPGXWAED-UHFFFAOYSA-N
MW363.80 g/mol
LogP2.83
Rot. Bonds4

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

N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide (PubChem CID 108532284) has the molecular formula C17H18ClN3O4 and a molecular weight of 363.80 g/mol. Its IUPAC name is N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide
PubChem CID108532284
Molecular FormulaC17H18ClN3O4
Molecular Weight363.80 g/mol
Exact Mass363.10
IUPAC NameN'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide
SMILESCOc1cc(NC(=O)C(=O)Nc2cc(C)ccc2N)c(OC)cc1Cl
InChIInChI=1S/C17H18ClN3O4/c1-9-4-5-11(19)12(6-9)20-16(22)17(23)21-13-8-14(24-2)10(18)7-15(13)25-3/h4-8H,19H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyDFPICFNPGXWAED-UHFFFAOYSA-N
XLogP2.83
TPSA102.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.80
LogP ≤ 52.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-5-methylphenyl)-N'-(4-chloro-2-methoxy-5-methylphenyl)oxamide
CID 108532479
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(4-chloro-2-methoxy-5-methylphenyl)oxamide
CID 108532266
N-(2-amino-5-methylphenyl)-N'-(2-methoxy-5-nitrophenyl)oxamide
CID 108532452
N'-(2-amino-5-methylphenyl)-N-(2-methoxy-4-nitrophenyl)oxamide
CID 108513088
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
CID 108502302
N'-(4-chloro-2,5-dimethoxyphenyl)-N-(2-hydroxyphenyl)oxamide
CID 108514378
ethyl 2-(4-chloro-2,5-dimethoxyanilino)-2-oxoacetate
CID 3311966
N'-(2-amino-5-methylphenyl)-N-(4-methoxyphenyl)oxamide
CID 108502699
N'-(2-amino-5-methylphenyl)-N-(3,5-dichlorophenyl)oxamide
CID 108531086
N'-tert-butyl-N-(4-chloro-2,5-dimethoxyphenyl)oxamide
CID 108506924
N-(4-chloro-2,5-dimethoxyphenyl)-N'-(2,5-difluorophenyl)oxamide
CID 108532288
N-(3,5-dichlorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 108515607

Frequently Asked Questions

What is the IUPAC name of N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide?
The IUPAC name of N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide (CID 108532284) is N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide.
What is the SMILES notation for N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide?
The canonical SMILES for N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide is COc1cc(NC(=O)C(=O)Nc2cc(C)ccc2N)c(OC)cc1Cl.
What is the InChIKey of N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide?
The InChIKey is DFPICFNPGXWAED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O4/c1-9-4-5-11(19)12(6-9)20-16(22)17(23)21-13-8-14(24-2)10(18)7-15(13)25-3/h4-8H,19H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide?
N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide has a molecular weight of 363.80 g/mol, XLogP of 2.83, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-amino-5-methylphenyl)-N-(4-chloro-2,5-dimethoxyphenyl)oxamide is sourced from PubChem (CID 108532284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).