2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide

C14H20FNO3 — CID 107318363

IUPAC2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide
SMILESCC(Oc1ccccc1F)C(=O)NCCCCCO
InChIInChI=1S/C14H20FNO3/c1-11(14(18)16-9-5-2-6-10-17)19-13-8-4-3-7-12(13)15/h3-4,7-8,11,17H,2,5-6,9-10H2,1H3,(H,16,18)
InChIKeyDWQWQEKMSUYDBN-UHFFFAOYSA-N
MW269.32 g/mol
LogP1.87
Rot. Bonds8

About 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide

2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide (PubChem CID 107318363) has the molecular formula C14H20FNO3 and a molecular weight of 269.32 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide
PubChem CID107318363
Molecular FormulaC14H20FNO3
Molecular Weight269.32 g/mol
Exact Mass269.14
IUPAC Name2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide
SMILESCC(Oc1ccccc1F)C(=O)NCCCCCO
InChIInChI=1S/C14H20FNO3/c1-11(14(18)16-9-5-2-6-10-17)19-13-8-4-3-7-12(13)15/h3-4,7-8,11,17H,2,5-6,9-10H2,1H3,(H,16,18)
InChIKeyDWQWQEKMSUYDBN-UHFFFAOYSA-N
XLogP1.87
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.32
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[2-(2-fluorophenoxy)propanoylamino]-2-methylpentanoic acid
CID 104682391
N-(6-hydroxyhexyl)-2-phenoxypropanamide
CID 103919352
2-(2-cyanophenoxy)-N-(4-hydroxybutyl)propanamide
CID 106843130
4-[2-(2-fluorophenoxy)propanoylamino]-2-hydroxybutanoic acid
CID 107832248
1-[2-(2-fluorophenoxy)propyl]-3-(3-hydroxypropyl)urea
CID 111508672
2-(2-fluorophenoxy)-N-[2-(methylamino)propyl]propanamide;hydrochloride
CID 120830406
2-(2-fluorophenoxy)-N-(2-hydroxy-4-methylpentyl)propanamide
CID 103771605
2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 43391422
4-[2-(2-fluorophenoxy)propanoylamino]-3-hydroxy-3-methylbutanoic acid
CID 66003733
(2S)-2-phenoxy-N-[9-[[(2S)-2-phenoxypropanoyl]amino]nonyl]propanamide
CID 28839964
(2S)-N-butyl-2-(2,5-difluorophenoxy)propanamide
CID 95973725
2-(2-nitrophenoxy)-N-[8-[2-(2-nitrophenoxy)propanoylamino]octyl]propanamide
CID 17233381

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide (CID 107318363) is 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide is CC(Oc1ccccc1F)C(=O)NCCCCCO.
What is the InChIKey of 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide?
The InChIKey is DWQWQEKMSUYDBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO3/c1-11(14(18)16-9-5-2-6-10-17)19-13-8-4-3-7-12(13)15/h3-4,7-8,11,17H,2,5-6,9-10H2,1H3,(H,16,18).
What are the key properties of 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide?
2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide has a molecular weight of 269.32 g/mol, XLogP of 1.87, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide is sourced from PubChem (CID 107318363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).