N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide

C19H21FN2O3 — CID 24979804

IUPACN'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide
SMILESCC(Oc1ccccc1F)C(=O)NNC(=O)CC(C)c1ccccc1
InChIInChI=1S/C19H21FN2O3/c1-13(15-8-4-3-5-9-15)12-18(23)21-22-19(24)14(2)25-17-11-7-6-10-16(17)20/h3-11,13-14H,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGWXJOLPALSEKQU-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.93
Rot. Bonds6

About N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide

N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide (PubChem CID 24979804) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide.

Molecular Properties

Compound NameN'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide
PubChem CID24979804
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC NameN'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide
SMILESCC(Oc1ccccc1F)C(=O)NNC(=O)CC(C)c1ccccc1
InChIInChI=1S/C19H21FN2O3/c1-13(15-8-4-3-5-9-15)12-18(23)21-22-19(24)14(2)25-17-11-7-6-10-16(17)20/h3-11,13-14H,12H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyGWXJOLPALSEKQU-UHFFFAOYSA-N
XLogP2.93
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.93
H-Bond Donors ≤ 52
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-(2-Phenylphenoxy)acetohydrazide
CID 870676
N'-[(4-chlorophenoxy)acetyl]-3-phenylpropanehydrazide
CID 1717957
N'-[2-(4-methoxyphenoxy)acetyl]-3-phenylpropanehydrazide
CID 3127332
3-Phenyl-propionic acid N'-[2-(4-tert-butyl-phenoxy)-acetyl]-hydrazide
CID 3127650
N'-(2-phenoxyacetyl)-3-phenylpropanehydrazide
CID 3139321
N'-[(2-methylphenoxy)acetyl]-3-phenylpropanehydrazide
CID 3139322
2-(3-methylphenoxy)-N'-(6-{2-[(3-methylphenoxy)acetyl]hydrazino}-6-oxohexanoyl)acetohydrazide
CID 4367965
N'-[2-(3-fluorophenoxy)acetyl]-3-(2-methylphenoxy)propanehydrazide
CID 2125221
N'-[2-(4-butan-2-ylphenoxy)acetyl]cyclohexanecarbohydrazide
CID 2965045
N'-[2-(4-cyanophenoxy)acetyl]cyclohexanecarbohydrazide
CID 2407482
N'-[2-(2-cyanophenoxy)acetyl]-3-cyclopentylpropanehydrazide
CID 2640774
N-[2-(4-bromophenoxy)acetylamino]-3-phenylpropanamide
CID 3139325

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide?
The IUPAC name of N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide (CID 24979804) is N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide.
What is the SMILES notation for N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide?
The canonical SMILES for N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide is CC(Oc1ccccc1F)C(=O)NNC(=O)CC(C)c1ccccc1.
What is the InChIKey of N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide?
The InChIKey is GWXJOLPALSEKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-13(15-8-4-3-5-9-15)12-18(23)21-22-19(24)14(2)25-17-11-7-6-10-16(17)20/h3-11,13-14H,12H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide?
N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide has a molecular weight of 344.39 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-fluorophenoxy)propanoyl]-3-phenylbutanehydrazide is sourced from PubChem (CID 24979804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).