2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide

C11H15FN2O2 — CID 116847913

IUPAC2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide
SMILESCN(C)NC(=O)COCc1cccc(F)c1
InChIInChI=1S/C11H15FN2O2/c1-14(2)13-11(15)8-16-7-9-4-3-5-10(12)6-9/h3-6H,7-8H2,1-2H3,(H,13,15)
InChIKeyFBQKOLWCWMRXHS-UHFFFAOYSA-N
MW226.25 g/mol
LogP0.94
Rot. Bonds5

About 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide

2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide (PubChem CID 116847913) has the molecular formula C11H15FN2O2 and a molecular weight of 226.25 g/mol. Its IUPAC name is 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide.

Molecular Properties

Compound Name2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide
PubChem CID116847913
Molecular FormulaC11H15FN2O2
Molecular Weight226.25 g/mol
Exact Mass226.11
IUPAC Name2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide
SMILESCN(C)NC(=O)COCc1cccc(F)c1
InChIInChI=1S/C11H15FN2O2/c1-14(2)13-11(15)8-16-7-9-4-3-5-10(12)6-9/h3-6H,7-8H2,1-2H3,(H,13,15)
InChIKeyFBQKOLWCWMRXHS-UHFFFAOYSA-N
XLogP0.94
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 50.94
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

2-[(4-ethoxy-3-methylphenyl)methoxy]-N',N'-dimethylacetohydrazide
CID 116847879
2-amino-3-(3-fluorophenyl)-N',N'-dimethylpropanehydrazide
CID 116849968
2-[2-[(3-fluorophenyl)methylamino]-2-oxoethoxy]acetic acid
CID 61328410
1-(2-ethoxyethoxymethyl)-3-fluorobenzene
CID 173202169
N-[(3-fluorophenyl)methyl]-2-methoxy-N-methylacetamide
CID 60636361
1-(2,5-difluorophenyl)-2-[(3-methoxyphenyl)methoxy]ethanone
CID 62031147
methyl 3-[4-[(3-fluorophenyl)methoxy]phenoxy]propanoate
CID 69037597
8-[(3-fluorophenyl)methoxy]octanoic acid
CID 66874952
1-[(3-fluorophenyl)methyl]-3-[3-(methoxymethyl)phenyl]-1-methylurea
CID 86988690
N-(3-fluorophenyl)-2-[(3-fluorophenyl)methyl-methylamino]acetamide
CID 9223772
N-(2-amino-2-oxoethoxy)-2-(3-fluorophenyl)acetamide
CID 112551000
2-[(3-bromophenyl)methoxy]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 82809087

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide?
The IUPAC name of 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide (CID 116847913) is 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide.
What is the SMILES notation for 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide?
The canonical SMILES for 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide is CN(C)NC(=O)COCc1cccc(F)c1.
What is the InChIKey of 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide?
The InChIKey is FBQKOLWCWMRXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O2/c1-14(2)13-11(15)8-16-7-9-4-3-5-10(12)6-9/h3-6H,7-8H2,1-2H3,(H,13,15).
What are the key properties of 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide?
2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide has a molecular weight of 226.25 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenyl)methoxy]-N',N'-dimethylacetohydrazide is sourced from PubChem (CID 116847913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).