2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide

C24H41NO4 — CID 14276077

IUPAC2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCC(C)C(=O)Nc1c(OC)cc(OC)cc1OC
InChIInChI=1S/C24H41NO4/c1-6-7-8-9-10-11-12-13-14-15-16-19(2)24(26)25-23-21(28-4)17-20(27-3)18-22(23)29-5/h17-19H,6-16H2,1-5H3,(H,25,26)
InChIKeyQFYXCKYDJGDGMU-UHFFFAOYSA-N
MW407.60 g/mol
LogP6.60
Rot. Bonds16

About 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide

2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide (PubChem CID 14276077) has the molecular formula C24H41NO4 and a molecular weight of 407.60 g/mol. Its IUPAC name is 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide.

Molecular Properties

Compound Name2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide
PubChem CID14276077
Molecular FormulaC24H41NO4
Molecular Weight407.60 g/mol
Exact Mass407.30
IUPAC Name2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCC(C)C(=O)Nc1c(OC)cc(OC)cc1OC
InChIInChI=1S/C24H41NO4/c1-6-7-8-9-10-11-12-13-14-15-16-19(2)24(26)25-23-21(28-4)17-20(27-3)18-22(23)29-5/h17-19H,6-16H2,1-5H3,(H,25,26)
InChIKeyQFYXCKYDJGDGMU-UHFFFAOYSA-N
XLogP6.60
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.60
LogP ≤ 56.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide?
The IUPAC name of 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide (CID 14276077) is 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide.
What is the SMILES notation for 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide?
The canonical SMILES for 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide is CCCCCCCCCCCCC(C)C(=O)Nc1c(OC)cc(OC)cc1OC.
What is the InChIKey of 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide?
The InChIKey is QFYXCKYDJGDGMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO4/c1-6-7-8-9-10-11-12-13-14-15-16-19(2)24(26)25-23-21(28-4)17-20(27-3)18-22(23)29-5/h17-19H,6-16H2,1-5H3,(H,25,26).
What are the key properties of 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide?
2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide has a molecular weight of 407.60 g/mol, XLogP of 6.60, 16 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2,4,6-trimethoxyphenyl)tetradecanamide is sourced from PubChem (CID 14276077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).