2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide

C17H15FN2O2 — CID 3151726

IUPAC2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide
SMILESO=C(NNC(=O)C1CC1c1ccccc1)c1ccccc1F
InChIInChI=1S/C17H15FN2O2/c18-15-9-5-4-8-12(15)16(21)19-20-17(22)14-10-13(14)11-6-2-1-3-7-11/h1-9,13-14H,10H2,(H,19,21)(H,20,22)
InChIKeyYAEBITLSTVDXEA-UHFFFAOYSA-N
MW298.32 g/mol
LogP2.39
Rot. Bonds3

About 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide

2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide (PubChem CID 3151726) has the molecular formula C17H15FN2O2 and a molecular weight of 298.32 g/mol. Its IUPAC name is 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide.

Molecular Properties

Compound Name2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide
PubChem CID3151726
Molecular FormulaC17H15FN2O2
Molecular Weight298.32 g/mol
Exact Mass298.11
IUPAC Name2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide
SMILESO=C(NNC(=O)C1CC1c1ccccc1)c1ccccc1F
InChIInChI=1S/C17H15FN2O2/c18-15-9-5-4-8-12(15)16(21)19-20-17(22)14-10-13(14)11-6-2-1-3-7-11/h1-9,13-14H,10H2,(H,19,21)(H,20,22)
InChIKeyYAEBITLSTVDXEA-UHFFFAOYSA-N
XLogP2.39
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 52.39
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 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide?
The IUPAC name of 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide (CID 3151726) is 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide.
What is the SMILES notation for 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide?
The canonical SMILES for 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide is O=C(NNC(=O)C1CC1c1ccccc1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide?
The InChIKey is YAEBITLSTVDXEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2/c18-15-9-5-4-8-12(15)16(21)19-20-17(22)14-10-13(14)11-6-2-1-3-7-11/h1-9,13-14H,10H2,(H,19,21)(H,20,22).
What are the key properties of 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide?
2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide has a molecular weight of 298.32 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N'-(2-phenylcyclopropanecarbonyl)benzohydrazide is sourced from PubChem (CID 3151726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).