2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide

C12H15FN2O4 — CID 47102861

IUPAC2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide
SMILESCOCC(=O)NNC(=O)C(C)Oc1ccccc1F
InChIInChI=1S/C12H15FN2O4/c1-8(12(17)15-14-11(16)7-18-2)19-10-6-4-3-5-9(10)13/h3-6,8H,7H2,1-2H3,(H,14,16)(H,15,17)
InChIKeySQHBOHAQLKVAHG-UHFFFAOYSA-N
MW270.26 g/mol
LogP0.39
Rot. Bonds5

About 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide

2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide (PubChem CID 47102861) has the molecular formula C12H15FN2O4 and a molecular weight of 270.26 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide
PubChem CID47102861
Molecular FormulaC12H15FN2O4
Molecular Weight270.26 g/mol
Exact Mass270.10
IUPAC Name2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide
SMILESCOCC(=O)NNC(=O)C(C)Oc1ccccc1F
InChIInChI=1S/C12H15FN2O4/c1-8(12(17)15-14-11(16)7-18-2)19-10-6-4-3-5-9(10)13/h3-6,8H,7H2,1-2H3,(H,14,16)(H,15,17)
InChIKeySQHBOHAQLKVAHG-UHFFFAOYSA-N
XLogP0.39
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-fluorophenoxy)-N'-[2-(2-fluorophenoxy)acetyl]propanehydrazide
CID 51156370
N-[3-[2-[2-(2-fluorophenoxy)propanoyl]hydrazinyl]-3-oxo-1-phenylpropyl]acetamide
CID 24982102
(2S)-N'-[2-(4-chlorophenoxy)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 7927413
N'-[2-(2-tert-butylphenoxy)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 46653812
2-(2-fluorophenoxy)-N'-[3-(4-fluorophenyl)propanoyl]propanehydrazide
CID 51195433
(2R)-N'-[2-(4-bromophenyl)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 7910909
N'-[2-(4-ethylphenoxy)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 78565397
(2S)-N'-[2-(2,6-dichlorophenyl)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 7760988
(2S)-2-(2-fluorophenoxy)-N'-[2-(4-fluorophenyl)sulfanylacetyl]propanehydrazide
CID 7910833
(2S)-N'-[2-(5-chloro-2-methoxyphenyl)acetyl]-2-(2-fluorophenoxy)propanehydrazide
CID 9087471
N-[(1S)-3-[2-[(2S)-2-(2-fluorophenoxy)propanoyl]hydrazinyl]-3-oxo-1-thiophen-2-ylpropyl]acetamide
CID 29432857
[3-[2-[2-(2-fluorophenoxy)propanoyl]hydrazinyl]-3-oxo-1-phenylpropyl]urea
CID 18286571

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide?
The IUPAC name of 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide (CID 47102861) is 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide?
The canonical SMILES for 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide is COCC(=O)NNC(=O)C(C)Oc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide?
The InChIKey is SQHBOHAQLKVAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O4/c1-8(12(17)15-14-11(16)7-18-2)19-10-6-4-3-5-9(10)13/h3-6,8H,7H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of 2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide?
2-(2-fluorophenoxy)-N'-(2-methoxyacetyl)propanehydrazide has a molecular weight of 270.26 g/mol, XLogP of 0.39, 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'-(2-methoxyacetyl)propanehydrazide is sourced from PubChem (CID 47102861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).