N-(2-ethylhexyl)-N'-phenyloxamide

C16H24N2O2 — CID 3102544

IUPACN-(2-ethylhexyl)-N'-phenyloxamide
SMILESCCCCC(CC)CNC(=O)C(=O)Nc1ccccc1
InChIInChI=1S/C16H24N2O2/c1-3-5-9-13(4-2)12-17-15(19)16(20)18-14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyRUVPZJNZLKRYQP-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.96
Rot. Bonds7

About N-(2-ethylhexyl)-N'-phenyloxamide

N-(2-ethylhexyl)-N'-phenyloxamide (PubChem CID 3102544) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-ethylhexyl)-N'-phenyloxamide.

Molecular Properties

Compound NameN-(2-ethylhexyl)-N'-phenyloxamide
PubChem CID3102544
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-ethylhexyl)-N'-phenyloxamide
SMILESCCCCC(CC)CNC(=O)C(=O)Nc1ccccc1
InChIInChI=1S/C16H24N2O2/c1-3-5-9-13(4-2)12-17-15(19)16(20)18-14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyRUVPZJNZLKRYQP-UHFFFAOYSA-N
XLogP2.96
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.96
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-[(2S)-2-ethylhexyl]-N'-(3-fluorophenyl)oxamide
CID 2291432
N-(2-ethylhexyl)-N'-(2-ethylphenyl)oxamide
CID 4656011
N'-(3,5-dimethylphenyl)-N-(2-ethylhexyl)oxamide
CID 4272614
N'-(3-chloro-4-methylphenyl)-N-[(2S)-2-ethylhexyl]oxamide
CID 2291750
ethyl 2-[4-[[4-[(2-ethoxy-2-oxoacetyl)amino]phenyl]methyl]anilino]-2-oxoacetate;N-(2-ethylhexyl)-N'-[4-[[4-[[2-(2-ethylhexylamino)-2-oxoacetyl]amino]phenyl]methyl]phenyl]oxamide
CID 161032414
N-butyl-N'-phenyloxamide
CID 2290889
1-(2-ethylbutyl)-3-phenylurea
CID 54410955
1-(2-ethylhexyl)-3-(2-hydroxy-2-phenylethyl)urea
CID 55739531
(2S)-2-amino-N-(2-ethylhexyl)-2-phenylacetamide
CID 104897632
N-(2-ethylhexyl)-3-phenylpropanamide
CID 3261802
N-(2-ethylhexyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 3116902
N-(2-ethylhexyl)-N'-(1,3-thiazol-5-yl)oxamide
CID 17201967

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylhexyl)-N'-phenyloxamide?
The IUPAC name of N-(2-ethylhexyl)-N'-phenyloxamide (CID 3102544) is N-(2-ethylhexyl)-N'-phenyloxamide.
What is the SMILES notation for N-(2-ethylhexyl)-N'-phenyloxamide?
The canonical SMILES for N-(2-ethylhexyl)-N'-phenyloxamide is CCCCC(CC)CNC(=O)C(=O)Nc1ccccc1.
What is the InChIKey of N-(2-ethylhexyl)-N'-phenyloxamide?
The InChIKey is RUVPZJNZLKRYQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-5-9-13(4-2)12-17-15(19)16(20)18-14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-ethylhexyl)-N'-phenyloxamide?
N-(2-ethylhexyl)-N'-phenyloxamide has a molecular weight of 276.38 g/mol, XLogP of 2.96, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylhexyl)-N'-phenyloxamide is sourced from PubChem (CID 3102544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).