N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide

C24H41NO2 — CID 58819419

IUPACN-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1cc(C(C)(C)C)ccc1O
InChIInChI=1S/C24H41NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-23(27)25-21-19-20(24(2,3)4)17-18-22(21)26/h17-19,26H,5-16H2,1-4H3,(H,25,27)
InChIKeyJLDZZMAJJWAFGT-UHFFFAOYSA-N
MW375.60 g/mol
LogP7.33
Rot. Bonds13

About N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide

N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide (PubChem CID 58819419) has the molecular formula C24H41NO2 and a molecular weight of 375.60 g/mol. Its IUPAC name is N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide.

Molecular Properties

Compound NameN-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide
PubChem CID58819419
Molecular FormulaC24H41NO2
Molecular Weight375.60 g/mol
Exact Mass375.31
IUPAC NameN-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1cc(C(C)(C)C)ccc1O
InChIInChI=1S/C24H41NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-23(27)25-21-19-20(24(2,3)4)17-18-22(21)26/h17-19,26H,5-16H2,1-4H3,(H,25,27)
InChIKeyJLDZZMAJJWAFGT-UHFFFAOYSA-N
XLogP7.33
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.60
LogP ≤ 57.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(5-tert-butyl-2-hydroxyphenyl)pentanamide
CID 29265334
N-(5-tert-butyl-2-hydroxyphenyl)-4-methoxybutanamide
CID 47266829
N-(2-hydroxy-5-phenylphenyl)octanamide
CID 155558351
N-(4-tert-butylphenyl)dodecanamide
CID 118504435
N-(3,5-ditert-butyl-2-hydroxyphenyl)hexanamide
CID 126701347
N-(3-tert-butyl-4-hydroxyphenyl)octadecanamide
CID 21290134
N-(3-tert-butyl-4-hydroxyphenyl)nonanamide
CID 21290138
N-(2-hydroxy-4,5-dimethylphenyl)tetradecanamide
CID 20778606
1-(5-tert-butyl-2-hydroxyphenyl)dodecan-1-one
CID 5212255
N,N'-bis(5-tert-butyl-2-hydroxyphenyl)oxamide
CID 10524086
5-amino-N-[2-hydroxy-5-(trifluoromethyl)phenyl]pentanamide
CID 81198138
(Z)-N-(2-hydroxyphenyl)octadec-9-enamide
CID 52916764

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide?
The IUPAC name of N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide (CID 58819419) is N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide.
What is the SMILES notation for N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide?
The canonical SMILES for N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1cc(C(C)(C)C)ccc1O.
What is the InChIKey of N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide?
The InChIKey is JLDZZMAJJWAFGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-23(27)25-21-19-20(24(2,3)4)17-18-22(21)26/h17-19,26H,5-16H2,1-4H3,(H,25,27).
What are the key properties of N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide?
N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide has a molecular weight of 375.60 g/mol, XLogP of 7.33, 13 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-2-hydroxyphenyl)tetradecanamide is sourced from PubChem (CID 58819419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).