N'-phenyl-N-propyloxamide

C11H14N2O2 — CID 2291438

IUPACN'-phenyl-N-propyloxamide
SMILESCCCNC(=O)C(=O)Nc1ccccc1
InChIInChI=1S/C11H14N2O2/c1-2-8-12-10(14)11(15)13-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14)(H,13,15)
InChIKeyROODIZBMLPFZFH-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.15
Rot. Bonds3

About N'-phenyl-N-propyloxamide

N'-phenyl-N-propyloxamide (PubChem CID 2291438) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is N'-phenyl-N-propyloxamide.

Molecular Properties

Compound NameN'-phenyl-N-propyloxamide
PubChem CID2291438
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC NameN'-phenyl-N-propyloxamide
SMILESCCCNC(=O)C(=O)Nc1ccccc1
InChIInChI=1S/C11H14N2O2/c1-2-8-12-10(14)11(15)13-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14)(H,13,15)
InChIKeyROODIZBMLPFZFH-UHFFFAOYSA-N
XLogP1.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N'-phenyloxamide
CID 2290889
S-[2-[(2-anilino-2-oxoacetyl)amino]ethyl] ethanethioate
CID 10945372
N-(3-methoxypropyl)-N'-phenyloxamide
CID 3437698
N-(6-hydroxyhexyl)-N'-phenyloxamide
CID 50850958
N-(3-hydroxy-4-methylpentyl)-N'-phenyloxamide
CID 111461297
2-oxo-3-phenyl-N-propylpropanamide
CID 68696691
N-propyl-N'-(4-pyrrolidin-1-ylphenyl)oxamide
CID 47226004
N-(2-ethylhexyl)-N'-phenyloxamide
CID 3102544
N-butyl-N'-(4-carbamoylphenyl)oxamide
CID 7584966
N-(2-phenylethyl)-N'-(4-propoxyphenyl)oxamide
CID 2966854
N-propyl-N'-pyrimidin-2-yloxamide
CID 44996511
2-(butylaminomethyl)-N-phenylprop-2-enamide
CID 10376659

Frequently Asked Questions

What is the IUPAC name of N'-phenyl-N-propyloxamide?
The IUPAC name of N'-phenyl-N-propyloxamide (CID 2291438) is N'-phenyl-N-propyloxamide.
What is the SMILES notation for N'-phenyl-N-propyloxamide?
The canonical SMILES for N'-phenyl-N-propyloxamide is CCCNC(=O)C(=O)Nc1ccccc1.
What is the InChIKey of N'-phenyl-N-propyloxamide?
The InChIKey is ROODIZBMLPFZFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-2-8-12-10(14)11(15)13-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,12,14)(H,13,15).
What are the key properties of N'-phenyl-N-propyloxamide?
N'-phenyl-N-propyloxamide has a molecular weight of 206.25 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-phenyl-N-propyloxamide is sourced from PubChem (CID 2291438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).