N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide

C20H26N4O2 — CID 108532401

IUPACN'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide
SMILESCCN(CC)c1ccc(NC(=O)C(=O)Nc2cc(C)ccc2N)c(C)c1
InChIInChI=1S/C20H26N4O2/c1-5-24(6-2)15-8-10-17(14(4)12-15)22-19(25)20(26)23-18-11-13(3)7-9-16(18)21/h7-12H,5-6,21H2,1-4H3,(H,22,25)(H,23,26)
InChIKeyIZTWOGSVQJKTTA-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.31
Rot. Bonds5

About N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide

N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide (PubChem CID 108532401) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide.

Molecular Properties

Compound NameN'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide
PubChem CID108532401
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC NameN'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide
SMILESCCN(CC)c1ccc(NC(=O)C(=O)Nc2cc(C)ccc2N)c(C)c1
InChIInChI=1S/C20H26N4O2/c1-5-24(6-2)15-8-10-17(14(4)12-15)22-19(25)20(26)23-18-11-13(3)7-9-16(18)21/h7-12H,5-6,21H2,1-4H3,(H,22,25)(H,23,26)
InChIKeyIZTWOGSVQJKTTA-UHFFFAOYSA-N
XLogP3.31
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(2-amino-5-methylphenyl)-N-(4-iodo-2-methylphenyl)oxamide
CID 108516453
methyl N-[4-(diethylamino)-2-methylphenyl]carbamate
CID 113098982
N'-[4-(diethylamino)-2-methylphenyl]-N-(3,4-dimethylphenyl)oxamide
CID 108523171
N'-(2-carbamoylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide
CID 108529438
N'-[4-(diethylamino)-2-methylphenyl]-N-(4-ethylphenyl)oxamide
CID 108522352
N-[4-(diethylamino)-2-methylphenyl]-N'-(2,6-difluorophenyl)oxamide
CID 108522130
N-[4-(diethylamino)-2-methylphenyl]-N'-(1,2,4-triazol-4-yl)oxamide
CID 108519226
N-(4-acetylphenyl)-N'-[4-(diethylamino)-2-methylphenyl]oxamide
CID 108514878
N-[4-(diethylamino)-2-methylphenyl]butanamide
CID 837078
N,N'-bis(2,4-dimethylphenyl)oxamide
CID 3416969
N-[4-(diethylamino)-2-methylphenyl]-N'-ethyl-N'-phenyloxamide
CID 108518693
1-[4-(diethylamino)-2-methylphenyl]-3-(2-fluoro-4-methylphenyl)thiourea
CID 53364968

Frequently Asked Questions

What is the IUPAC name of N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide?
The IUPAC name of N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide (CID 108532401) is N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide.
What is the SMILES notation for N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide?
The canonical SMILES for N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide is CCN(CC)c1ccc(NC(=O)C(=O)Nc2cc(C)ccc2N)c(C)c1.
What is the InChIKey of N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide?
The InChIKey is IZTWOGSVQJKTTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-5-24(6-2)15-8-10-17(14(4)12-15)22-19(25)20(26)23-18-11-13(3)7-9-16(18)21/h7-12H,5-6,21H2,1-4H3,(H,22,25)(H,23,26).
What are the key properties of N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide?
N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide has a molecular weight of 354.45 g/mol, XLogP of 3.31, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-amino-5-methylphenyl)-N-[4-(diethylamino)-2-methylphenyl]oxamide is sourced from PubChem (CID 108532401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).