N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide

C24H41NO3 — CID 54789458

IUPACN-[3-(2-ethoxyethoxy)phenyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1cccc(OCCOCC)c1
InChIInChI=1S/C24H41NO3/c1-3-5-6-7-8-9-10-11-12-13-14-18-24(26)25-22-16-15-17-23(21-22)28-20-19-27-4-2/h15-17,21H,3-14,18-20H2,1-2H3,(H,25,26)
InChIKeyAYZHOUYYUNGVNQ-UHFFFAOYSA-N
MW391.60 g/mol
LogP6.74
Rot. Bonds18

About N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide

N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide (PubChem CID 54789458) has the molecular formula C24H41NO3 and a molecular weight of 391.60 g/mol. Its IUPAC name is N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide.

Molecular Properties

Compound NameN-[3-(2-ethoxyethoxy)phenyl]tetradecanamide
PubChem CID54789458
Molecular FormulaC24H41NO3
Molecular Weight391.60 g/mol
Exact Mass391.31
IUPAC NameN-[3-(2-ethoxyethoxy)phenyl]tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1cccc(OCCOCC)c1
InChIInChI=1S/C24H41NO3/c1-3-5-6-7-8-9-10-11-12-13-14-18-24(26)25-22-16-15-17-23(21-22)28-20-19-27-4-2/h15-17,21H,3-14,18-20H2,1-2H3,(H,25,26)
InChIKeyAYZHOUYYUNGVNQ-UHFFFAOYSA-N
XLogP6.74
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.60
LogP ≤ 56.74
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,N'-bis(3-hexoxyphenyl)nonanediamide
CID 17094975
N-[3-[[2-[4-(2-ethoxyethoxy)anilino]-2-oxoethyl]amino]phenyl]hexanamide
CID 54841252
2-[2-(2-ethoxyethoxy)anilino]-N-(3-heptoxyphenyl)acetamide
CID 54827601
N-[(3-butoxyphenyl)carbamothioyl]octanamide
CID 17095226
N-[(3-heptoxyphenyl)carbamothioyl]tetradecanamide
CID 54791342
N-[3-(2-amino-2-sulfanylideneethoxy)phenyl]octanamide
CID 43369412
N-[3-(cyanomethoxy)phenyl]-4-ethoxybutanamide
CID 47228165
3-(2-aminophenyl)-N-[3-(2-ethoxyethoxy)phenyl]propanamide
CID 54795478
6-(3-ethoxyanilino)-6-oxohexanoic acid
CID 54866810
2-[3-(2-ethoxyethoxy)anilino]-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54827581
ethyl 7-(3-ethoxyanilino)-7-oxoheptanoate
CID 139378123
2-(ethylamino)-N-(3-hexoxyphenyl)acetamide
CID 54820702

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide?
The IUPAC name of N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide (CID 54789458) is N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide.
What is the SMILES notation for N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide?
The canonical SMILES for N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1cccc(OCCOCC)c1.
What is the InChIKey of N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide?
The InChIKey is AYZHOUYYUNGVNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO3/c1-3-5-6-7-8-9-10-11-12-13-14-18-24(26)25-22-16-15-17-23(21-22)28-20-19-27-4-2/h15-17,21H,3-14,18-20H2,1-2H3,(H,25,26).
What are the key properties of N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide?
N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide has a molecular weight of 391.60 g/mol, XLogP of 6.74, 18 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethoxyethoxy)phenyl]tetradecanamide is sourced from PubChem (CID 54789458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).