N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide

C15H14ClN3O3 — CID 108515975

IUPACN'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide
SMILESCOc1cccc(NC(=O)C(=O)Nc2ccc(N)c(Cl)c2)c1
InChIInChI=1S/C15H14ClN3O3/c1-22-11-4-2-3-9(7-11)18-14(20)15(21)19-10-5-6-13(17)12(16)8-10/h2-8H,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyJVYBIBCEVAHIRQ-UHFFFAOYSA-N
MW319.75 g/mol
LogP2.51
Rot. Bonds3

About N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide

N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide (PubChem CID 108515975) has the molecular formula C15H14ClN3O3 and a molecular weight of 319.75 g/mol. Its IUPAC name is N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide
PubChem CID108515975
Molecular FormulaC15H14ClN3O3
Molecular Weight319.75 g/mol
Exact Mass319.07
IUPAC NameN'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide
SMILESCOc1cccc(NC(=O)C(=O)Nc2ccc(N)c(Cl)c2)c1
InChIInChI=1S/C15H14ClN3O3/c1-22-11-4-2-3-9(7-11)18-14(20)15(21)19-10-5-6-13(17)12(16)8-10/h2-8H,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyJVYBIBCEVAHIRQ-UHFFFAOYSA-N
XLogP2.51
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.75
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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'-(3-acetylphenyl)-N-(4-amino-3-chlorophenyl)oxamide
CID 108514915
1-(4-amino-3-chlorophenyl)-3-(3,5-dimethoxyphenyl)urea
CID 108869425
N'-(2-chlorophenyl)-N-(3-methoxyphenyl)oxamide
CID 45000733
1-(3,4-diaminophenyl)-3-(3-methoxyphenyl)urea
CID 155694037
N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
CID 108516155
N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
CID 108516241
1-(4-amino-3-chlorophenyl)-3-(4-methoxyphenyl)urea
CID 82861747
N'-(3-methoxyphenyl)-N-(4-phenoxyphenyl)oxamide
CID 44999403
N'-(3-bromophenyl)-N-(3-methoxyphenyl)oxamide
CID 108519610
N-(4-amino-3-chlorophenyl)-N'-(3,5-dimethylphenyl)oxamide
CID 108516205
N-(4-amino-3-chlorophenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
CID 108502189
N'-(2-chloro-5-nitrophenyl)-N-(3-methoxyphenyl)oxamide
CID 108513447

Frequently Asked Questions

What is the IUPAC name of N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
The IUPAC name of N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide (CID 108515975) is N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide.
What is the SMILES notation for N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
The canonical SMILES for N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide is COc1cccc(NC(=O)C(=O)Nc2ccc(N)c(Cl)c2)c1.
What is the InChIKey of N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
The InChIKey is JVYBIBCEVAHIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O3/c1-22-11-4-2-3-9(7-11)18-14(20)15(21)19-10-5-6-13(17)12(16)8-10/h2-8H,17H2,1H3,(H,18,20)(H,19,21).
What are the key properties of N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide?
N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide has a molecular weight of 319.75 g/mol, XLogP of 2.51, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide is sourced from PubChem (CID 108515975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).