3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide

C14H20FNO4 — CID 103799162

IUPAC3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide
SMILESCOCC(CCO)NC(=O)CCOc1ccc(F)cc1
InChIInChI=1S/C14H20FNO4/c1-19-10-12(6-8-17)16-14(18)7-9-20-13-4-2-11(15)3-5-13/h2-5,12,17H,6-10H2,1H3,(H,16,18)
InChIKeyDDDWWCNDGQZNKA-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.11
Rot. Bonds9

About 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide

3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide (PubChem CID 103799162) has the molecular formula C14H20FNO4 and a molecular weight of 285.31 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide.

Molecular Properties

Compound Name3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide
PubChem CID103799162
Molecular FormulaC14H20FNO4
Molecular Weight285.31 g/mol
Exact Mass285.14
IUPAC Name3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide
SMILESCOCC(CCO)NC(=O)CCOc1ccc(F)cc1
InChIInChI=1S/C14H20FNO4/c1-19-10-12(6-8-17)16-14(18)7-9-20-13-4-2-11(15)3-5-13/h2-5,12,17H,6-10H2,1H3,(H,16,18)
InChIKeyDDDWWCNDGQZNKA-UHFFFAOYSA-N
XLogP1.11
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-fluorophenyl)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide
CID 103799465
N-(1-aminohexan-2-yl)-3-(4-fluorophenoxy)propanamide
CID 119665882
2-(4-aminophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)acetamide
CID 106151936
3-(4-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 43060182
2-(2-fluorophenyl)-N-(4-hydroxy-1-methoxybutan-2-yl)acetamide
CID 103799437
3-(4-fluorophenoxy)-N-(2-methoxyethyl)propanamide
CID 110678607
3-(2,2-difluoroethoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide
CID 103525153
2-(2,4-difluorophenyl)sulfanyl-N-(4-hydroxy-1-methoxybutan-2-yl)acetamide
CID 103850779
4-[(4-hydroxy-1-methoxybutan-2-yl)amino]-4-oxobutanoic acid
CID 106155382
N-(4-hydroxy-1-methoxybutan-2-yl)-2-(4-methylphenyl)acetamide
CID 103799183
N-(4-fluorophenyl)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159602
N-(4-hydroxy-1-methoxybutan-2-yl)-3-(4-methylphenyl)propanamide
CID 103799440

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide?
The IUPAC name of 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide (CID 103799162) is 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide.
What is the SMILES notation for 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide?
The canonical SMILES for 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide is COCC(CCO)NC(=O)CCOc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide?
The InChIKey is DDDWWCNDGQZNKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO4/c1-19-10-12(6-8-17)16-14(18)7-9-20-13-4-2-11(15)3-5-13/h2-5,12,17H,6-10H2,1H3,(H,16,18).
What are the key properties of 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide?
3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide has a molecular weight of 285.31 g/mol, XLogP of 1.11, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide is sourced from PubChem (CID 103799162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).