N'-(4-dodecylphenyl)oxamide

C20H32N2O2 — CID 118096540

IUPACN'-(4-dodecylphenyl)oxamide
SMILESCCCCCCCCCCCCc1ccc(NC(=O)C(N)=O)cc1
InChIInChI=1S/C20H32N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22-20(24)19(21)23/h13-16H,2-12H2,1H3,(H2,21,23)(H,22,24)
InChIKeyGXVIJPMRGORLKJ-UHFFFAOYSA-N
MW332.49 g/mol
LogP4.57
Rot. Bonds12

About N'-(4-dodecylphenyl)oxamide

N'-(4-dodecylphenyl)oxamide (PubChem CID 118096540) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N'-(4-dodecylphenyl)oxamide.

Molecular Properties

Compound NameN'-(4-dodecylphenyl)oxamide
PubChem CID118096540
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC NameN'-(4-dodecylphenyl)oxamide
SMILESCCCCCCCCCCCCc1ccc(NC(=O)C(N)=O)cc1
InChIInChI=1S/C20H32N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22-20(24)19(21)23/h13-16H,2-12H2,1H3,(H2,21,23)(H,22,24)
InChIKeyGXVIJPMRGORLKJ-UHFFFAOYSA-N
XLogP4.57
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis(4-butylphenyl)oxamide
CID 3438016
N-(4-dodecylphenyl)-2-methylprop-2-enamide
CID 58819798
N-(4-heptylphenyl)heptanamide
CID 101077737
1-(4-heptylphenyl)-3-propylurea
CID 142021842
N'-(4-butylphenyl)-N-pentyloxamide
CID 108502416
6-amino-N-(4-pentylphenyl)hexanamide
CID 61248961
5-amino-N-(4-octylphenyl)furan-2-carboxamide
CID 142608726
4-amino-N-(4-pentylphenyl)butanamide
CID 61248586
(3S)-2-amino-3-hydroxy-N-(4-octylphenyl)butanamide
CID 70668692
(2S,3S)-2-amino-3-hydroxy-N-(4-octylphenyl)butanamide
CID 45483299
2-(methylamino)-N-(4-pentylphenyl)acetamide
CID 61249144
3-amino-2-methyl-N-(4-pentylphenyl)propanamide
CID 62670377

Frequently Asked Questions

What is the IUPAC name of N'-(4-dodecylphenyl)oxamide?
The IUPAC name of N'-(4-dodecylphenyl)oxamide (CID 118096540) is N'-(4-dodecylphenyl)oxamide.
What is the SMILES notation for N'-(4-dodecylphenyl)oxamide?
The canonical SMILES for N'-(4-dodecylphenyl)oxamide is CCCCCCCCCCCCc1ccc(NC(=O)C(N)=O)cc1.
What is the InChIKey of N'-(4-dodecylphenyl)oxamide?
The InChIKey is GXVIJPMRGORLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22-20(24)19(21)23/h13-16H,2-12H2,1H3,(H2,21,23)(H,22,24).
What are the key properties of N'-(4-dodecylphenyl)oxamide?
N'-(4-dodecylphenyl)oxamide has a molecular weight of 332.49 g/mol, XLogP of 4.57, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-dodecylphenyl)oxamide is sourced from PubChem (CID 118096540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).