N-[6-(2-phenylethoxy)hexyl]acetamide

C16H25NO2 — CID 67657412

IUPACN-[6-(2-phenylethoxy)hexyl]acetamide
SMILESCC(=O)NCCCCCCOCCc1ccccc1
InChIInChI=1S/C16H25NO2/c1-15(18)17-12-7-2-3-8-13-19-14-11-16-9-5-4-6-10-16/h4-6,9-10H,2-3,7-8,11-14H2,1H3,(H,17,18)
InChIKeyKLOWRIUFKIVCFM-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.94
Rot. Bonds10

About N-[6-(2-phenylethoxy)hexyl]acetamide

N-[6-(2-phenylethoxy)hexyl]acetamide (PubChem CID 67657412) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[6-(2-phenylethoxy)hexyl]acetamide.

Molecular Properties

Compound NameN-[6-(2-phenylethoxy)hexyl]acetamide
PubChem CID67657412
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[6-(2-phenylethoxy)hexyl]acetamide
SMILESCC(=O)NCCCCCCOCCc1ccccc1
InChIInChI=1S/C16H25NO2/c1-15(18)17-12-7-2-3-8-13-19-14-11-16-9-5-4-6-10-16/h4-6,9-10H,2-3,7-8,11-14H2,1H3,(H,17,18)
InChIKeyKLOWRIUFKIVCFM-UHFFFAOYSA-N
XLogP2.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.94
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

(2S)-2-amino-3-methyl-N-[4-(2-phenylethoxy)butyl]butanamide
CID 119293937
(2S)-2-amino-N-[3-(2-phenylethoxy)propyl]propanamide
CID 119298276
N-[4-(2-benzylsulfanyl-3-hexadecoxypropoxy)butyl]acetamide
CID 71324355
2-methyl-3-(methylamino)-N-[3-(2-phenylethoxy)propyl]propanamide;hydrochloride
CID 119739688
N-[4-(2-phenylethoxy)butyl]pyrrolidine-3-carboxamide
CID 119731795
1-(4-ethoxybutyl)-2-methyl-3-[3-(2-phenylethoxy)propyl]guanidine;hydroiodide
CID 111946076
(2S)-2-amino-4-methyl-N-[3-(2-phenylethoxy)propyl]pentanamide
CID 119739711
N-[6-[2,3-dihydroxy-4,5,6-tris(phenylmethoxy)cyclohexyl]oxyhexyl]acetamide
CID 18970877
1-ethyl-3-[4-(2-phenylethoxy)butyl]-2-propylguanidine
CID 111227861
2-amino-2-(4-methylphenyl)-N-[3-(2-phenylethoxy)propyl]acetamide
CID 120667657
2-pentoxyethylbenzene
CID 3022447
4-[[6-(2-phenylethoxy)hexylamino]methyl]phenol
CID 174549086

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-phenylethoxy)hexyl]acetamide?
The IUPAC name of N-[6-(2-phenylethoxy)hexyl]acetamide (CID 67657412) is N-[6-(2-phenylethoxy)hexyl]acetamide.
What is the SMILES notation for N-[6-(2-phenylethoxy)hexyl]acetamide?
The canonical SMILES for N-[6-(2-phenylethoxy)hexyl]acetamide is CC(=O)NCCCCCCOCCc1ccccc1.
What is the InChIKey of N-[6-(2-phenylethoxy)hexyl]acetamide?
The InChIKey is KLOWRIUFKIVCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-15(18)17-12-7-2-3-8-13-19-14-11-16-9-5-4-6-10-16/h4-6,9-10H,2-3,7-8,11-14H2,1H3,(H,17,18).
What are the key properties of N-[6-(2-phenylethoxy)hexyl]acetamide?
N-[6-(2-phenylethoxy)hexyl]acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.94, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-phenylethoxy)hexyl]acetamide is sourced from PubChem (CID 67657412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).