N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide

C18H21N3O3 — CID 45001237

IUPACN-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide
SMILESCCOc1ccccc1NC(=O)C(=O)Nc1ccc(N(C)C)cc1
InChIInChI=1S/C18H21N3O3/c1-4-24-16-8-6-5-7-15(16)20-18(23)17(22)19-13-9-11-14(12-10-13)21(2)3/h5-12H,4H2,1-3H3,(H,19,22)(H,20,23)
InChIKeyQRIQVWALPUTADI-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.73
Rot. Bonds5

About N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide

N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide (PubChem CID 45001237) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide
PubChem CID45001237
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC NameN-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide
SMILESCCOc1ccccc1NC(=O)C(=O)Nc1ccc(N(C)C)cc1
InChIInChI=1S/C18H21N3O3/c1-4-24-16-8-6-5-7-15(16)20-18(23)17(22)19-13-9-11-14(12-10-13)21(2)3/h5-12H,4H2,1-3H3,(H,19,22)(H,20,23)
InChIKeyQRIQVWALPUTADI-UHFFFAOYSA-N
XLogP2.73
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)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

1-[4-(dimethylamino)phenyl]-3-(2-ethoxyphenyl)urea
CID 108894849
N-[4-(dimethylamino)phenyl]-2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylacetamide
CID 1412036
N'-(2-ethoxyphenyl)-N-(4-iodophenyl)oxamide
CID 108531107
N-[(2S)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-N'-(2-ethoxyphenyl)oxamide
CID 7192247
N-[3-[4-(dimethylamino)phenyl]propyl]-N'-(2-ethoxyphenyl)oxamide
CID 16892036
N'-(2-ethoxyphenyl)-N-(4-propan-2-yloxyphenyl)oxamide
CID 108987263
N-(2-ethoxyphenyl)-N',N'-dipropyloxamide
CID 108528706
N-(2-ethoxyphenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108528439
N-[4-(diethylamino)phenyl]-N'-(2-ethoxyphenyl)-2,2-dimethylpropanediamide
CID 108969471
1-[4-(dimethylamino)phenyl]-3-[2-(2-ethoxyphenyl)ethyl]urea
CID 3552165
N-[(2S)-2-[4-(dimethylamino)phenyl]-2-pyrrolidin-1-ium-1-ylethyl]-N'-(2-ethoxyphenyl)oxamide
CID 7644813
N-(4-hydroxyphenyl)-N'-(2-propoxyphenyl)oxamide
CID 163646977

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide?
The IUPAC name of N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide (CID 45001237) is N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide.
What is the SMILES notation for N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide?
The canonical SMILES for N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide is CCOc1ccccc1NC(=O)C(=O)Nc1ccc(N(C)C)cc1.
What is the InChIKey of N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide?
The InChIKey is QRIQVWALPUTADI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-4-24-16-8-6-5-7-15(16)20-18(23)17(22)19-13-9-11-14(12-10-13)21(2)3/h5-12H,4H2,1-3H3,(H,19,22)(H,20,23).
What are the key properties of N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide?
N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide has a molecular weight of 327.38 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)phenyl]-N'-(2-ethoxyphenyl)oxamide is sourced from PubChem (CID 45001237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).