N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide

C11H14FNO4 — CID 65315333

IUPACN-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide
SMILESO=C(COc1ccc(F)cc1)NC(CO)CO
InChIInChI=1S/C11H14FNO4/c12-8-1-3-10(4-2-8)17-7-11(16)13-9(5-14)6-15/h1-4,9,14-15H,5-7H2,(H,13,16)
InChIKeyYVLSZAKHUYOPAS-UHFFFAOYSA-N
MW243.23 g/mol
LogP-0.33
Rot. Bonds6

About N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide

N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide (PubChem CID 65315333) has the molecular formula C11H14FNO4 and a molecular weight of 243.23 g/mol. Its IUPAC name is N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide
PubChem CID65315333
Molecular FormulaC11H14FNO4
Molecular Weight243.23 g/mol
Exact Mass243.09
IUPAC NameN-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide
SMILESO=C(COc1ccc(F)cc1)NC(CO)CO
InChIInChI=1S/C11H14FNO4/c12-8-1-3-10(4-2-8)17-7-11(16)13-9(5-14)6-15/h1-4,9,14-15H,5-7H2,(H,13,16)
InChIKeyYVLSZAKHUYOPAS-UHFFFAOYSA-N
XLogP-0.33
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.23
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-dihydroxypropan-2-yl)-2-(4-methylphenoxy)acetamide
CID 65312489
N-(1,3-dihydroxypropan-2-yl)-2-(4-methoxyphenoxy)acetamide
CID 65313044
(2S)-2-[[2-(4-fluorophenoxy)acetyl]amino]propanoic acid
CID 92918438
N-[1-(4-fluorophenyl)ethyl]-2-[4-(hydroxymethyl)phenoxy]acetamide
CID 110876946
N-[(1R)-1-(4-fluorophenyl)ethyl]-2-(4-methylphenoxy)acetamide
CID 2632446
2-(3-fluorophenoxy)-N-(1-hydroxy-3-methoxypropan-2-yl)acetamide
CID 114078973
N-(1-hydroxy-4-methylpentan-2-yl)-2-phenoxyacetamide
CID 61245289
2-(4-aminophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 61026509
N-cyano-2-(4-fluorophenoxy)acetamide
CID 79194261
2-(4-chlorophenoxy)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 39086751
2-[[2-(4-fluorophenoxy)acetyl]amino]-4-methoxybutanoic acid
CID 62480729
2-(4-ethylphenoxy)-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide
CID 26561037

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide?
The IUPAC name of N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide (CID 65315333) is N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide.
What is the SMILES notation for N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide?
The canonical SMILES for N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide is O=C(COc1ccc(F)cc1)NC(CO)CO.
What is the InChIKey of N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide?
The InChIKey is YVLSZAKHUYOPAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO4/c12-8-1-3-10(4-2-8)17-7-11(16)13-9(5-14)6-15/h1-4,9,14-15H,5-7H2,(H,13,16).
What are the key properties of N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide?
N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide has a molecular weight of 243.23 g/mol, XLogP of -0.33, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dihydroxypropan-2-yl)-2-(4-fluorophenoxy)acetamide is sourced from PubChem (CID 65315333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).