N-(2-butoxyphenyl)tetradecanamide

C24H41NO2 — CID 54789601

IUPACN-(2-butoxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccccc1OCCCC
InChIInChI=1S/C24H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-20-24(26)25-22-18-16-17-19-23(22)27-21-6-4-2/h16-19H,3-15,20-21H2,1-2H3,(H,25,26)
InChIKeyMGFUFGQEVOOEAR-UHFFFAOYSA-N
MW375.60 g/mol
LogP7.51
Rot. Bonds17

About N-(2-butoxyphenyl)tetradecanamide

N-(2-butoxyphenyl)tetradecanamide (PubChem CID 54789601) has the molecular formula C24H41NO2 and a molecular weight of 375.60 g/mol. Its IUPAC name is N-(2-butoxyphenyl)tetradecanamide.

Molecular Properties

Compound NameN-(2-butoxyphenyl)tetradecanamide
PubChem CID54789601
Molecular FormulaC24H41NO2
Molecular Weight375.60 g/mol
Exact Mass375.31
IUPAC NameN-(2-butoxyphenyl)tetradecanamide
SMILESCCCCCCCCCCCCCC(=O)Nc1ccccc1OCCCC
InChIInChI=1S/C24H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-20-24(26)25-22-18-16-17-19-23(22)27-21-6-4-2/h16-19H,3-15,20-21H2,1-2H3,(H,25,26)
InChIKeyMGFUFGQEVOOEAR-UHFFFAOYSA-N
XLogP7.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.60
LogP ≤ 57.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis(2-butoxyphenyl)hexanediamide
CID 17087317
14-(2-butoxyanilino)-14-oxotetradecanoic acid
CID 57100527
N-(2-ethoxyphenyl)octanamide
CID 4158866
N-(2-butoxyphenyl)propanamide
CID 15943029
5-chloro-N-(2-propoxyphenyl)pentanamide
CID 43697480
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
12-[2-(4-carboxybutoxy)anilino]-12-oxododecanoic acid
CID 18796099
10-[2-(3-carboxypropoxy)anilino]-10-oxodecanoic acid
CID 18796122
N-(2-phenoxyphenyl)decanamide
CID 4091110
1,3-bis(2-butoxyphenyl)urea
CID 17170447
N,N'-bis[2-(2-phenoxyethoxy)phenyl]decanediamide
CID 17130993
N-[2-[2-(diethylamino)ethoxy]phenyl]pentanamide
CID 71898997

Frequently Asked Questions

What is the IUPAC name of N-(2-butoxyphenyl)tetradecanamide?
The IUPAC name of N-(2-butoxyphenyl)tetradecanamide (CID 54789601) is N-(2-butoxyphenyl)tetradecanamide.
What is the SMILES notation for N-(2-butoxyphenyl)tetradecanamide?
The canonical SMILES for N-(2-butoxyphenyl)tetradecanamide is CCCCCCCCCCCCCC(=O)Nc1ccccc1OCCCC.
What is the InChIKey of N-(2-butoxyphenyl)tetradecanamide?
The InChIKey is MGFUFGQEVOOEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H41NO2/c1-3-5-7-8-9-10-11-12-13-14-15-20-24(26)25-22-18-16-17-19-23(22)27-21-6-4-2/h16-19H,3-15,20-21H2,1-2H3,(H,25,26).
What are the key properties of N-(2-butoxyphenyl)tetradecanamide?
N-(2-butoxyphenyl)tetradecanamide has a molecular weight of 375.60 g/mol, XLogP of 7.51, 17 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyphenyl)tetradecanamide is sourced from PubChem (CID 54789601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).