N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide

C16H17N3O4 — CID 7584781

IUPACN'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide
SMILESCC(=O)Nc1cccc(NC(=O)C(=O)NCCc2ccco2)c1
InChIInChI=1S/C16H17N3O4/c1-11(20)18-12-4-2-5-13(10-12)19-16(22)15(21)17-8-7-14-6-3-9-23-14/h2-6,9-10H,7-8H2,1H3,(H,17,21)(H,18,20)(H,19,22)
InChIKeyDNUCMCPYBIPHFI-UHFFFAOYSA-N
MW315.33 g/mol
LogP1.54
Rot. Bonds5

About N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide

N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide (PubChem CID 7584781) has the molecular formula C16H17N3O4 and a molecular weight of 315.33 g/mol. Its IUPAC name is N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide.

Molecular Properties

Compound NameN'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide
PubChem CID7584781
Molecular FormulaC16H17N3O4
Molecular Weight315.33 g/mol
Exact Mass315.12
IUPAC NameN'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide
SMILESCC(=O)Nc1cccc(NC(=O)C(=O)NCCc2ccco2)c1
InChIInChI=1S/C16H17N3O4/c1-11(20)18-12-4-2-5-13(10-12)19-16(22)15(21)17-8-7-14-6-3-9-23-14/h2-6,9-10H,7-8H2,1H3,(H,17,21)(H,18,20)(H,19,22)
InChIKeyDNUCMCPYBIPHFI-UHFFFAOYSA-N
XLogP1.54
TPSA100.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]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-(furan-2-yl)ethyl]-2-methylprop-2-enamide
CID 178173949
methyl 4-[[2-[2-(furan-2-yl)ethylamino]-2-oxoacetyl]amino]benzoate
CID 7585241
N'-(4-ethoxyphenyl)-N-[2-(furan-2-yl)ethyl]oxamide
CID 7584904
N'-(3-acetamidophenyl)-N-(2-aminoethyl)oxamide
CID 43316047
N-[3-[[[N-[2-(furan-2-yl)ethyl]-N'-methylcarbamimidoyl]amino]methyl]phenyl]acetamide;hydroiodide
CID 111354021
N-[2-(furan-2-yl)ethyl]-N'-(4-nitrophenyl)oxamide
CID 7584723
N'-(3-bromophenyl)-N-(furan-2-ylmethyl)oxamide
CID 47224195
N'-(3-acetamidophenyl)-N-phenyloxamide
CID 45001278
N-(2-acetamidoethyl)-N'-(3-fluorophenyl)oxamide
CID 47226155
N'-(3-acetamidophenyl)-N-[2-(4-methyl-2-pyrrolidin-1-yl-1,3-thiazol-5-yl)ethyl]oxamide
CID 171505794
2-[[ethylamino-[2-(furan-2-yl)ethylamino]methylidene]amino]-N-(3-ethylphenyl)acetamide
CID 111354256
N'-(3-acetamidophenyl)-N-[2-[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethyl]oxamide
CID 27460897

Frequently Asked Questions

What is the IUPAC name of N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide?
The IUPAC name of N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide (CID 7584781) is N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide.
What is the SMILES notation for N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide?
The canonical SMILES for N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide is CC(=O)Nc1cccc(NC(=O)C(=O)NCCc2ccco2)c1.
What is the InChIKey of N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide?
The InChIKey is DNUCMCPYBIPHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4/c1-11(20)18-12-4-2-5-13(10-12)19-16(22)15(21)17-8-7-14-6-3-9-23-14/h2-6,9-10H,7-8H2,1H3,(H,17,21)(H,18,20)(H,19,22).
What are the key properties of N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide?
N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide has a molecular weight of 315.33 g/mol, XLogP of 1.54, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]oxamide is sourced from PubChem (CID 7584781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).