N-(2-ethylphenyl)undecanamide

C19H31NO — CID 5078439

IUPACN-(2-ethylphenyl)undecanamide
SMILESCCCCCCCCCCC(=O)Nc1ccccc1CC
InChIInChI=1S/C19H31NO/c1-3-5-6-7-8-9-10-11-16-19(21)20-18-15-13-12-14-17(18)4-2/h12-15H,3-11,16H2,1-2H3,(H,20,21)
InChIKeyHKBMXYKLWPMTMF-UHFFFAOYSA-N
MW289.46 g/mol
LogP5.72
Rot. Bonds11

About N-(2-ethylphenyl)undecanamide

N-(2-ethylphenyl)undecanamide (PubChem CID 5078439) has the molecular formula C19H31NO and a molecular weight of 289.46 g/mol. Its IUPAC name is N-(2-ethylphenyl)undecanamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)undecanamide
PubChem CID5078439
Molecular FormulaC19H31NO
Molecular Weight289.46 g/mol
Exact Mass289.24
IUPAC NameN-(2-ethylphenyl)undecanamide
SMILESCCCCCCCCCCC(=O)Nc1ccccc1CC
InChIInChI=1S/C19H31NO/c1-3-5-6-7-8-9-10-11-16-19(21)20-18-15-13-12-14-17(18)4-2/h12-15H,3-11,16H2,1-2H3,(H,20,21)
InChIKeyHKBMXYKLWPMTMF-UHFFFAOYSA-N
XLogP5.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.46
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 4582103
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CID 65425982
N-(2-chlorophenyl)octanamide
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N-naphthalen-1-yldodecanamide
CID 588517
N-(2-aminophenyl)octadecanamide
CID 68839220
(Z)-N-(2-hydroxyphenyl)octadec-9-enamide
CID 52916764
2-(hexacosanoylamino)benzoic acid
CID 123304158
N,N'-bis(2-ethylphenyl)propanediamide
CID 3881876
N-(2-chlorophenyl)hexanamide
CID 4644560
N-(2-fluorophenyl)hexanamide
CID 3481165
N-[2-(ethylaminomethyl)phenyl]pentanamide;hydrochloride
CID 119438958
12-hydroxy-N-[2-(12-hydroxyoctadecanoylamino)phenyl]octadecanamide
CID 70182552

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)undecanamide?
The IUPAC name of N-(2-ethylphenyl)undecanamide (CID 5078439) is N-(2-ethylphenyl)undecanamide.
What is the SMILES notation for N-(2-ethylphenyl)undecanamide?
The canonical SMILES for N-(2-ethylphenyl)undecanamide is CCCCCCCCCCC(=O)Nc1ccccc1CC.
What is the InChIKey of N-(2-ethylphenyl)undecanamide?
The InChIKey is HKBMXYKLWPMTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NO/c1-3-5-6-7-8-9-10-11-16-19(21)20-18-15-13-12-14-17(18)4-2/h12-15H,3-11,16H2,1-2H3,(H,20,21).
What are the key properties of N-(2-ethylphenyl)undecanamide?
N-(2-ethylphenyl)undecanamide has a molecular weight of 289.46 g/mol, XLogP of 5.72, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)undecanamide is sourced from PubChem (CID 5078439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).