N-(4-hydroxy-3-methylphenyl)tetradecanamide

C21H35NO2 — CID 91054297

IUPACN-(4-hydroxy-3-methylphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccc(O)c(C)c1
InChIInChI=1S/C21H35NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(24)22-19-15-16-20(23)18(2)17-19/h15-17,23H,3-14H2,1-2H3,(H,22,24)
InChIKeyKTBMHZGHNOUQOW-UHFFFAOYSA-N
MW333.52 g/mol
LogP6.34
Rot. Bonds13

About N-(4-hydroxy-3-methylphenyl)tetradecanamide

N-(4-hydroxy-3-methylphenyl)tetradecanamide (PubChem CID 91054297) has the molecular formula C21H35NO2 and a molecular weight of 333.52 g/mol. Its IUPAC name is N-(4-hydroxy-3-methylphenyl)tetradecanamide.

Molecular Properties

Compound NameN-(4-hydroxy-3-methylphenyl)tetradecanamide
PubChem CID91054297
Molecular FormulaC21H35NO2
Molecular Weight333.52 g/mol
Exact Mass333.27
IUPAC NameN-(4-hydroxy-3-methylphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccc(O)c(C)c1
InChIInChI=1S/C21H35NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(24)22-19-15-16-20(23)18(2)17-19/h15-17,23H,3-14H2,1-2H3,(H,22,24)
InChIKeyKTBMHZGHNOUQOW-UHFFFAOYSA-N
XLogP6.34
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.52
LogP ≤ 56.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3,4-dimethylphenyl)dodecanamide
CID 4067786
N-(3-fluoro-4-hydroxyphenyl)decanamide
CID 65426538
N-(3-butyl-4-hydroxyphenyl)tetradecanamide
CID 142641305
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-(3-tert-butyl-4-hydroxyphenyl)octadecanamide
CID 21290134
N-(3-tert-butyl-4-hydroxyphenyl)nonanamide
CID 21290138
N-[4-(3-hydroxyprop-1-ynyl)-3-methylphenyl]octanamide
CID 60803124
N-(3-hydroxyphenyl)nonadecanamide
CID 19039287
N-(4-hydroxyphenyl)-6-(2-octadecanoylhydrazinyl)-6-oxohexanamide
CID 139759322
2-[4-(dodecanoylamino)-2-methylpyridin-1-ium-1-yl]acetic acid
CID 121282813
N-(4-acetamidophenyl)hexanamide
CID 4953736
N-[4-(4-hydroxyphenyl)phenyl]octanamide
CID 139889893

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-3-methylphenyl)tetradecanamide?
The IUPAC name of N-(4-hydroxy-3-methylphenyl)tetradecanamide (CID 91054297) is N-(4-hydroxy-3-methylphenyl)tetradecanamide.
What is the SMILES notation for N-(4-hydroxy-3-methylphenyl)tetradecanamide?
The canonical SMILES for N-(4-hydroxy-3-methylphenyl)tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1ccc(O)c(C)c1.
What is the InChIKey of N-(4-hydroxy-3-methylphenyl)tetradecanamide?
The InChIKey is KTBMHZGHNOUQOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(24)22-19-15-16-20(23)18(2)17-19/h15-17,23H,3-14H2,1-2H3,(H,22,24).
What are the key properties of N-(4-hydroxy-3-methylphenyl)tetradecanamide?
N-(4-hydroxy-3-methylphenyl)tetradecanamide has a molecular weight of 333.52 g/mol, XLogP of 6.34, 13 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-3-methylphenyl)tetradecanamide is sourced from PubChem (CID 91054297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).