N-(4-butan-2-ylphenyl)tetradecanamide

C24H41NO — CID 4191696

IUPACN-(4-butan-2-ylphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccc(C(C)CC)cc1
InChIInChI=1S/C24H41NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-24(26)25-23-19-17-22(18-20-23)21(3)5-2/h17-21H,4-16H2,1-3H3,(H,25,26)
InChIKeyYIAAOEWMDDNBHT-UHFFFAOYSA-N
MW359.60 g/mol
LogP7.84
Rot. Bonds15

About N-(4-butan-2-ylphenyl)tetradecanamide

N-(4-butan-2-ylphenyl)tetradecanamide (PubChem CID 4191696) has the molecular formula C24H41NO and a molecular weight of 359.60 g/mol. Its IUPAC name is N-(4-butan-2-ylphenyl)tetradecanamide.

Molecular Properties

Compound NameN-(4-butan-2-ylphenyl)tetradecanamide
PubChem CID4191696
Molecular FormulaC24H41NO
Molecular Weight359.60 g/mol
Exact Mass359.32
IUPAC NameN-(4-butan-2-ylphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccc(C(C)CC)cc1
InChIInChI=1S/C24H41NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-24(26)25-23-19-17-22(18-20-23)21(3)5-2/h17-21H,4-16H2,1-3H3,(H,25,26)
InChIKeyYIAAOEWMDDNBHT-UHFFFAOYSA-N
XLogP7.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.60
LogP ≤ 57.84
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

N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-[4-(1-aminoethyl)phenyl]nonanamide
CID 65449674
N-[4-[1-(methylamino)ethyl]phenyl]nonanamide
CID 65449865
3-[4-(pentanoylamino)phenyl]butanoic acid
CID 113419992
2-(4-butan-2-ylphenoxy)-N-(4-heptoxyphenyl)acetamide
CID 4959333
N-(4-acetamidophenyl)hexanamide
CID 4953736
N-[4-[(2R)-butan-2-yl]phenyl]-2-chloroacetamide
CID 2384376
N-(4-chlorophenyl)tridecanamide
CID 4195215
2-amino-N-(4-butan-2-ylphenyl)acetamide
CID 43218233
N-phenylpentacosanamide
CID 19025260
N-phenylheptatetracontanamide
CID 150503307
ethyl 4-(4-butan-2-ylanilino)-4-oxobutanoate
CID 60637740

Frequently Asked Questions

What is the IUPAC name of N-(4-butan-2-ylphenyl)tetradecanamide?
The IUPAC name of N-(4-butan-2-ylphenyl)tetradecanamide (CID 4191696) is N-(4-butan-2-ylphenyl)tetradecanamide.
What is the SMILES notation for N-(4-butan-2-ylphenyl)tetradecanamide?
The canonical SMILES for N-(4-butan-2-ylphenyl)tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1ccc(C(C)CC)cc1.
What is the InChIKey of N-(4-butan-2-ylphenyl)tetradecanamide?
The InChIKey is YIAAOEWMDDNBHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-24(26)25-23-19-17-22(18-20-23)21(3)5-2/h17-21H,4-16H2,1-3H3,(H,25,26).
What are the key properties of N-(4-butan-2-ylphenyl)tetradecanamide?
N-(4-butan-2-ylphenyl)tetradecanamide has a molecular weight of 359.60 g/mol, XLogP of 7.84, 15 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butan-2-ylphenyl)tetradecanamide is sourced from PubChem (CID 4191696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).