2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide

C14H18FNO4 — CID 103954074

IUPAC2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESO=C(COc1ccccc1F)NC1(CO)CCOCC1
InChIInChI=1S/C14H18FNO4/c15-11-3-1-2-4-12(11)20-9-13(18)16-14(10-17)5-7-19-8-6-14/h1-4,17H,5-10H2,(H,16,18)
InChIKeyUHWHHGZWQIYILK-UHFFFAOYSA-N
MW283.30 g/mol
LogP0.86
Rot. Bonds5

About 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide

2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (PubChem CID 103954074) has the molecular formula C14H18FNO4 and a molecular weight of 283.30 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
PubChem CID103954074
Molecular FormulaC14H18FNO4
Molecular Weight283.30 g/mol
Exact Mass283.12
IUPAC Name2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
SMILESO=C(COc1ccccc1F)NC1(CO)CCOCC1
InChIInChI=1S/C14H18FNO4/c15-11-3-1-2-4-12(11)20-9-13(18)16-14(10-17)5-7-19-8-6-14/h1-4,17H,5-10H2,(H,16,18)
InChIKeyUHWHHGZWQIYILK-UHFFFAOYSA-N
XLogP0.86
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-(2-fluorophenoxy)acetyl]amino]oxolane-3-carboxylic acid
CID 64889416
2-(4-chlorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
CID 103954312
2-(2,4-difluorophenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62519487
3-(2-fluorophenoxy)-N-[1-(hydroxymethyl)cyclobutyl]propanamide
CID 115878515
2-(2,5-dimethylphenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide
CID 103954073
2,6-difluoro-N-[4-(hydroxymethyl)oxan-4-yl]benzamide
CID 106298371
N-[4-(hydroxymethyl)oxan-4-yl]-2-(4-methoxyphenoxy)acetamide
CID 104630643
N-[1-(hydroxymethyl)cyclobutyl]-2-(2-methoxyphenoxy)acetamide
CID 115878022
(E)-3-(2-fluorophenyl)-N-[4-(hydroxymethyl)oxan-4-yl]prop-2-enamide
CID 104630693
N-(2,6-difluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 892688
N-[4-(hydroxymethyl)oxan-4-yl]-2-methoxybenzamide
CID 103954290
4-(2-fluorophenoxy)-N-[(4-phenyloxan-4-yl)methyl]butanamide
CID 171138751

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide (CID 103954074) is 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is O=C(COc1ccccc1F)NC1(CO)CCOCC1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
The InChIKey is UHWHHGZWQIYILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO4/c15-11-3-1-2-4-12(11)20-9-13(18)16-14(10-17)5-7-19-8-6-14/h1-4,17H,5-10H2,(H,16,18).
What are the key properties of 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide?
2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide has a molecular weight of 283.30 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[4-(hydroxymethyl)oxan-4-yl]acetamide is sourced from PubChem (CID 103954074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).