N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide

C13H19NO3 — CID 110678275

IUPACN-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide
SMILESCCc1cccc(C)c1NC(=O)COCCO
InChIInChI=1S/C13H19NO3/c1-3-11-6-4-5-10(2)13(11)14-12(16)9-17-8-7-15/h4-6,15H,3,7-9H2,1-2H3,(H,14,16)
InChIKeyRMYYFCYOEOLYQS-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.50
Rot. Bonds6

About N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide

N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide (PubChem CID 110678275) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide
PubChem CID110678275
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide
SMILESCCc1cccc(C)c1NC(=O)COCCO
InChIInChI=1S/C13H19NO3/c1-3-11-6-4-5-10(2)13(11)14-12(16)9-17-8-7-15/h4-6,15H,3,7-9H2,1-2H3,(H,14,16)
InChIKeyRMYYFCYOEOLYQS-UHFFFAOYSA-N
XLogP1.50
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-(2-ethyl-6-methylanilino)-2-oxoethyl] acetate
CID 2109366
N-(2-ethyl-6-methylphenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178089
2-(3,5-dimethylphenoxy)-N-(2-ethyl-6-methylphenyl)acetamide
CID 769435
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N-(2-ethyl-6-methylphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19172373
N-(2-ethyl-6-methylphenyl)-2-(2-methoxyphenoxy)acetamide
CID 717648
[2-(2-ethyl-6-methylanilino)-2-oxoethyl] 4-(hydroxymethyl)benzoate
CID 2636706
N-(2-ethyl-6-methylphenyl)-4-oxopentanamide
CID 11839711
N-(2,6-dimethylphenyl)-2-(2-phenylethoxy)acetamide
CID 86871191
N-(2,6-dimethylphenyl)-2-(2-ethylphenoxy)acetamide
CID 19175719
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
N'-(2-ethyl-6-methylphenyl)butanediamide
CID 82041304

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide (CID 110678275) is N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide is CCc1cccc(C)c1NC(=O)COCCO.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide?
The InChIKey is RMYYFCYOEOLYQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-3-11-6-4-5-10(2)13(11)14-12(16)9-17-8-7-15/h4-6,15H,3,7-9H2,1-2H3,(H,14,16).
What are the key properties of N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide?
N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide has a molecular weight of 237.30 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-2-(2-hydroxyethoxy)acetamide is sourced from PubChem (CID 110678275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).