2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide

C14H18FNO3 — CID 78956697

IUPAC2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide
SMILESCC(Oc1ccccc1F)C(=O)NCC1(C)COC1
InChIInChI=1S/C14H18FNO3/c1-10(19-12-6-4-3-5-11(12)15)13(17)16-7-14(2)8-18-9-14/h3-6,10H,7-9H2,1-2H3,(H,16,17)
InChIKeyPGWSLMVUHKJZBG-UHFFFAOYSA-N
MW267.30 g/mol
LogP1.75
Rot. Bonds5

About 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide

2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide (PubChem CID 78956697) has the molecular formula C14H18FNO3 and a molecular weight of 267.30 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide
PubChem CID78956697
Molecular FormulaC14H18FNO3
Molecular Weight267.30 g/mol
Exact Mass267.13
IUPAC Name2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide
SMILESCC(Oc1ccccc1F)C(=O)NCC1(C)COC1
InChIInChI=1S/C14H18FNO3/c1-10(19-12-6-4-3-5-11(12)15)13(17)16-7-14(2)8-18-9-14/h3-6,10H,7-9H2,1-2H3,(H,16,17)
InChIKeyPGWSLMVUHKJZBG-UHFFFAOYSA-N
XLogP1.75
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluorophenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]propanamide
CID 79037138
2-(2-bromo-4-chlorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide
CID 78957043
1-[[2-(2-fluorophenoxy)propanoylamino]methyl]cyclohexane-1-carboxylic acid
CID 120545014
1-(2-fluorophenyl)-3-[(3-methyloxetan-3-yl)methyl]urea
CID 112690764
2-(2-fluorophenoxy)-N-(5-hydroxypentyl)propanamide
CID 107318363
2-(2-fluorophenoxy)-N-[2-(methylamino)propyl]propanamide;hydrochloride
CID 120830406
4-[2-(2-fluorophenoxy)propanoylamino]-2-hydroxybutanoic acid
CID 107832248
2-(2-fluorophenoxy)-N-(2-hydroxy-4-methylpentyl)propanamide
CID 103771605
5-[2-(2-fluorophenoxy)propanoylamino]-2-methylpentanoic acid
CID 104682391
N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)methyl]-2-(2-fluorophenoxy)propanamide
CID 121137500
(2R)-2-(2-fluorophenoxy)-N-[(4-methoxyphenyl)methyl]propanamide
CID 7892059
(2S)-N-carbamoyl-2-(2-fluorophenoxy)propanamide
CID 7815239

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide (CID 78956697) is 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide is CC(Oc1ccccc1F)C(=O)NCC1(C)COC1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The InChIKey is PGWSLMVUHKJZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO3/c1-10(19-12-6-4-3-5-11(12)15)13(17)16-7-14(2)8-18-9-14/h3-6,10H,7-9H2,1-2H3,(H,16,17).
What are the key properties of 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide?
2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide has a molecular weight of 267.30 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[(3-methyloxetan-3-yl)methyl]propanamide is sourced from PubChem (CID 78956697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).