3-(2-fluorophenoxy)-N-methoxypropanamide

C10H12FNO3 — CID 60717911

IUPAC3-(2-fluorophenoxy)-N-methoxypropanamide
SMILESCONC(=O)CCOc1ccccc1F
InChIInChI=1S/C10H12FNO3/c1-14-12-10(13)6-7-15-9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,12,13)
InChIKeyZXCIMXKYUFUBCP-UHFFFAOYSA-N
MW213.21 g/mol
LogP1.27
Rot. Bonds5

About 3-(2-fluorophenoxy)-N-methoxypropanamide

3-(2-fluorophenoxy)-N-methoxypropanamide (PubChem CID 60717911) has the molecular formula C10H12FNO3 and a molecular weight of 213.21 g/mol. Its IUPAC name is 3-(2-fluorophenoxy)-N-methoxypropanamide.

Molecular Properties

Compound Name3-(2-fluorophenoxy)-N-methoxypropanamide
PubChem CID60717911
Molecular FormulaC10H12FNO3
Molecular Weight213.21 g/mol
Exact Mass213.08
IUPAC Name3-(2-fluorophenoxy)-N-methoxypropanamide
SMILESCONC(=O)CCOc1ccccc1F
InChIInChI=1S/C10H12FNO3/c1-14-12-10(13)6-7-15-9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,12,13)
InChIKeyZXCIMXKYUFUBCP-UHFFFAOYSA-N
XLogP1.27
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.21
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl 2-[3-(2-fluorophenoxy)propanoylamino]propanoate
CID 60638002
N-(2-aminoethyl)-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119382925
3-(2-fluorophenoxy)-N-propylpropanamide
CID 60637780
4-(2-fluorophenoxy)butan-2-one
CID 28948853
N-[3-(aminomethyl)pentan-3-yl]-3-(2-fluorophenoxy)propanamide
CID 119569535
3-(2-fluorophenoxy)-N-(4-fluorophenyl)propanamide
CID 47097682
3-(2-fluorophenoxy)-N-(2-hydroxyethyl)propanamide
CID 43388959
3-(2-fluorophenoxy)-N-(2-hydroxy-2-methylpropyl)propanamide
CID 65109845
(2R)-2-[3-(2-fluorophenoxy)propanoylamino]propanoic acid
CID 54990985
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-(2-fluorophenoxy)propanamide
CID 107845510
3-(2-fluorophenoxy)-N-[2-(methylamino)propyl]propanamide
CID 120831531
N-[2-(ethylamino)ethyl]-3-(2-fluorophenoxy)propanamide;hydrochloride
CID 119505851

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenoxy)-N-methoxypropanamide?
The IUPAC name of 3-(2-fluorophenoxy)-N-methoxypropanamide (CID 60717911) is 3-(2-fluorophenoxy)-N-methoxypropanamide.
What is the SMILES notation for 3-(2-fluorophenoxy)-N-methoxypropanamide?
The canonical SMILES for 3-(2-fluorophenoxy)-N-methoxypropanamide is CONC(=O)CCOc1ccccc1F.
What is the InChIKey of 3-(2-fluorophenoxy)-N-methoxypropanamide?
The InChIKey is ZXCIMXKYUFUBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO3/c1-14-12-10(13)6-7-15-9-5-3-2-4-8(9)11/h2-5H,6-7H2,1H3,(H,12,13).
What are the key properties of 3-(2-fluorophenoxy)-N-methoxypropanamide?
3-(2-fluorophenoxy)-N-methoxypropanamide has a molecular weight of 213.21 g/mol, XLogP of 1.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenoxy)-N-methoxypropanamide is sourced from PubChem (CID 60717911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).