N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide

C24H41NO — CID 4525427

IUPACN-[(2,4,5-trimethylphenyl)methyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)NCc1cc(C)c(C)cc1C
InChIInChI=1S/C24H41NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-24(26)25-19-23-18-21(3)20(2)17-22(23)4/h17-18H,5-16,19H2,1-4H3,(H,25,26)
InChIKeyMCIWEBMJUCWUJW-UHFFFAOYSA-N
MW359.60 g/mol
LogP6.93
Rot. Bonds14

About N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide

N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide (PubChem CID 4525427) has the molecular formula C24H41NO and a molecular weight of 359.60 g/mol. Its IUPAC name is N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide.

Molecular Properties

Compound NameN-[(2,4,5-trimethylphenyl)methyl]tetradecanamide
PubChem CID4525427
Molecular FormulaC24H41NO
Molecular Weight359.60 g/mol
Exact Mass359.32
IUPAC NameN-[(2,4,5-trimethylphenyl)methyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)NCc1cc(C)c(C)cc1C
InChIInChI=1S/C24H41NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-24(26)25-19-23-18-21(3)20(2)17-22(23)4/h17-18H,5-16,19H2,1-4H3,(H,25,26)
InChIKeyMCIWEBMJUCWUJW-UHFFFAOYSA-N
XLogP6.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.60
LogP ≤ 56.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2,4,5-trimethylphenyl)methyl]propanamide
CID 110783031
N-[[2-[(tricosanoylamino)methyl]phenyl]methyl]tricosanamide
CID 101291084
3-chloro-N-[(2,4,5-trimethylphenyl)methyl]propanamide
CID 115162512
N-[(2-hydroxyphenyl)methyl]octadecanamide
CID 154122787
N-[[4-[(octanoylamino)methyl]phenyl]methyl]octanamide
CID 3350050
N-[(5-amino-2-hydroxyphenyl)methyl]octanamide
CID 43548602
N-[[3-[(henicosanoylamino)methyl]phenyl]methyl]henicosanamide
CID 101291080
N-[(4-methylphenyl)methyl]heptanamide
CID 4159981
N-[(4-methylphenyl)methyl]hexadecanamide
CID 11111158
N-[(2-chlorophenyl)methyl]tetradecanamide
CID 54789460
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]hexanamide
CID 38743387
N-[(2-chloro-4,5-dimethoxyphenyl)methyl]hexanamide
CID 54785381

Frequently Asked Questions

What is the IUPAC name of N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide?
The IUPAC name of N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide (CID 4525427) is N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide.
What is the SMILES notation for N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide?
The canonical SMILES for N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide is CCCCCCCCCCCCCC(=O)NCc1cc(C)c(C)cc1C.
What is the InChIKey of N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide?
The InChIKey is MCIWEBMJUCWUJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-24(26)25-19-23-18-21(3)20(2)17-22(23)4/h17-18H,5-16,19H2,1-4H3,(H,25,26).
What are the key properties of N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide?
N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide has a molecular weight of 359.60 g/mol, XLogP of 6.93, 14 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4,5-trimethylphenyl)methyl]tetradecanamide is sourced from PubChem (CID 4525427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).