2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide

C14H21NO2 — CID 135170128

IUPAC2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide
SMILESCCC(CC(C)C)C(=O)Nc1ccccc1O
InChIInChI=1S/C14H21NO2/c1-4-11(9-10(2)3)14(17)15-12-7-5-6-8-13(12)16/h5-8,10-11,16H,4,9H2,1-3H3,(H,15,17)
InChIKeyRALKEVBETOWAKN-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.40
Rot. Bonds5

About 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide

2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide (PubChem CID 135170128) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide.

Molecular Properties

Compound Name2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide
PubChem CID135170128
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide
SMILESCCC(CC(C)C)C(=O)Nc1ccccc1O
InChIInChI=1S/C14H21NO2/c1-4-11(9-10(2)3)14(17)15-12-7-5-6-8-13(12)16/h5-8,10-11,16H,4,9H2,1-3H3,(H,15,17)
InChIKeyRALKEVBETOWAKN-UHFFFAOYSA-N
XLogP3.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-N-(2-hydroxyphenyl)-4,4-dimethylpentanamide
CID 143326178
2-bromo-N-(2-hydroxyphenyl)-4-methylpentanamide
CID 119094650
2-hydroxy-N-(2-hydroxyphenyl)propanamide
CID 83768320
N,N'-bis(2-methylphenyl)-2-(2-methylpropyl)pentanediamide
CID 154750234
2-bromo-N-(2-hydroxyphenyl)-3-methylbutanamide
CID 14234666
2-ethyl-N-(2-hydroxy-4-methylphenyl)butanamide
CID 1234613
2-(2-ethylbutanoylamino)benzamide
CID 1214109
2,3,6-trimethylheptan-4-yl N-(2-hydroxyphenyl)carbamate
CID 129206856
N-(2-ethylphenyl)-2-methylbutanamide
CID 3140517
2-ethyl-N-[2-[1-(propylamino)ethyl]phenyl]butanamide
CID 43508040
4-amino-2-ethyl-N-(2-ethylphenyl)butanamide
CID 112515504
methane;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 4-[(2-hydroxyphenyl)carbamoyl]-2-methylhexanoate
CID 158925624

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide?
The IUPAC name of 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide (CID 135170128) is 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide.
What is the SMILES notation for 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide?
The canonical SMILES for 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide is CCC(CC(C)C)C(=O)Nc1ccccc1O.
What is the InChIKey of 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide?
The InChIKey is RALKEVBETOWAKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-11(9-10(2)3)14(17)15-12-7-5-6-8-13(12)16/h5-8,10-11,16H,4,9H2,1-3H3,(H,15,17).
What are the key properties of 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide?
2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide has a molecular weight of 235.33 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-hydroxyphenyl)-4-methylpentanamide is sourced from PubChem (CID 135170128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).