N-(2,5-dimethoxyphenyl)hexadecanamide

C24H41NO3 — CID 20789890

IUPACN-(2,5-dimethoxyphenyl)hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)Nc1cc(OC)ccc1OC
InChIInChI=1S/C24H41NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(26)25-22-20-21(27-2)18-19-23(22)28-3/h18-20H,4-17H2,1-3H3,(H,25,26)
InChIKeyXVTQEPFZHFWQTB-UHFFFAOYSA-N
MW391.60 g/mol
LogP7.12
Rot. Bonds17

About N-(2,5-dimethoxyphenyl)hexadecanamide

N-(2,5-dimethoxyphenyl)hexadecanamide (PubChem CID 20789890) has the molecular formula C24H41NO3 and a molecular weight of 391.60 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)hexadecanamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)hexadecanamide
PubChem CID20789890
Molecular FormulaC24H41NO3
Molecular Weight391.60 g/mol
Exact Mass391.31
IUPAC NameN-(2,5-dimethoxyphenyl)hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)Nc1cc(OC)ccc1OC
InChIInChI=1S/C24H41NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(26)25-22-20-21(27-2)18-19-23(22)28-3/h18-20H,4-17H2,1-3H3,(H,25,26)
InChIKeyXVTQEPFZHFWQTB-UHFFFAOYSA-N
XLogP7.12
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.60
LogP ≤ 57.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-dimethoxyphenyl)undecanamide
CID 4139645
N,N'-bis(2,5-dimethoxyphenyl)butanediamide
CID 1011774
N-(2-methoxy-5-methylphenyl)dodecanamide
CID 4196048
N-(5-bromo-2-methoxyphenyl)octanamide
CID 60540438
N-(2,5-dimethoxyphenyl)-2-(heptylamino)acetamide
CID 54814780
N-(2,5-dimethoxyphenyl)-4-(ethylamino)butanamide
CID 67149586
N-(2-amino-4-methoxyphenyl)nonanamide
CID 65449480
5-methoxy-2-(octanoylamino)benzoic acid
CID 78980039
2-(heptanoylamino)-5-methoxybenzoic acid
CID 115410928
N-[(Z)-[4-(2,5-dimethoxyanilino)-4-oxobutan-2-ylidene]amino]pentanamide
CID 6029887
N,N'-bis(5-methoxy-2-methylphenyl)decanediamide
CID 10670784
N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
CID 17034633

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)hexadecanamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)hexadecanamide (CID 20789890) is N-(2,5-dimethoxyphenyl)hexadecanamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)hexadecanamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)hexadecanamide is CCCCCCCCCCCCCCCC(=O)Nc1cc(OC)ccc1OC.
What is the InChIKey of N-(2,5-dimethoxyphenyl)hexadecanamide?
The InChIKey is XVTQEPFZHFWQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(26)25-22-20-21(27-2)18-19-23(22)28-3/h18-20H,4-17H2,1-3H3,(H,25,26).
What are the key properties of N-(2,5-dimethoxyphenyl)hexadecanamide?
N-(2,5-dimethoxyphenyl)hexadecanamide has a molecular weight of 391.60 g/mol, XLogP of 7.12, 17 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)hexadecanamide is sourced from PubChem (CID 20789890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).