N'-(3-fluorophenyl)propanehydrazide

C9H11FN2O — CID 131132295

IUPACN'-(3-fluorophenyl)propanehydrazide
SMILESCCC(=O)NNc1cccc(F)c1
InChIInChI=1S/C9H11FN2O/c1-2-9(13)12-11-8-5-3-4-7(10)6-8/h3-6,11H,2H2,1H3,(H,12,13)
InChIKeyUSSWFZAFNIVLQB-UHFFFAOYSA-N
MW182.20 g/mol
LogP1.68
Rot. Bonds3

About N'-(3-fluorophenyl)propanehydrazide

N'-(3-fluorophenyl)propanehydrazide (PubChem CID 131132295) has the molecular formula C9H11FN2O and a molecular weight of 182.20 g/mol. Its IUPAC name is N'-(3-fluorophenyl)propanehydrazide.

Molecular Properties

Compound NameN'-(3-fluorophenyl)propanehydrazide
PubChem CID131132295
Molecular FormulaC9H11FN2O
Molecular Weight182.20 g/mol
Exact Mass182.09
IUPAC NameN'-(3-fluorophenyl)propanehydrazide
SMILESCCC(=O)NNc1cccc(F)c1
InChIInChI=1S/C9H11FN2O/c1-2-9(13)12-11-8-5-3-4-7(10)6-8/h3-6,11H,2H2,1H3,(H,12,13)
InChIKeyUSSWFZAFNIVLQB-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(3-fluorophenyl)propanehydrazide?
The IUPAC name of N'-(3-fluorophenyl)propanehydrazide (CID 131132295) is N'-(3-fluorophenyl)propanehydrazide.
What is the SMILES notation for N'-(3-fluorophenyl)propanehydrazide?
The canonical SMILES for N'-(3-fluorophenyl)propanehydrazide is CCC(=O)NNc1cccc(F)c1.
What is the InChIKey of N'-(3-fluorophenyl)propanehydrazide?
The InChIKey is USSWFZAFNIVLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O/c1-2-9(13)12-11-8-5-3-4-7(10)6-8/h3-6,11H,2H2,1H3,(H,12,13).
What are the key properties of N'-(3-fluorophenyl)propanehydrazide?
N'-(3-fluorophenyl)propanehydrazide has a molecular weight of 182.20 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-fluorophenyl)propanehydrazide is sourced from PubChem (CID 131132295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).