2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide

C15H13FN2O3 — CID 59422019

IUPAC2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
SMILESO=C(Cc1cccc(O)c1)NNC(=O)c1ccccc1F
InChIInChI=1S/C15H13FN2O3/c16-13-7-2-1-6-12(13)15(21)18-17-14(20)9-10-4-3-5-11(19)8-10/h1-8,19H,9H2,(H,17,20)(H,18,21)
InChIKeyLMLQCRNHFQDREN-UHFFFAOYSA-N
MW288.28 g/mol
LogP1.53
Rot. Bonds3

About 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide

2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide (PubChem CID 59422019) has the molecular formula C15H13FN2O3 and a molecular weight of 288.28 g/mol. Its IUPAC name is 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide.

Molecular Properties

Compound Name2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
PubChem CID59422019
Molecular FormulaC15H13FN2O3
Molecular Weight288.28 g/mol
Exact Mass288.09
IUPAC Name2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
SMILESO=C(Cc1cccc(O)c1)NNC(=O)c1ccccc1F
InChIInChI=1S/C15H13FN2O3/c16-13-7-2-1-6-12(13)15(21)18-17-14(20)9-10-4-3-5-11(19)8-10/h1-8,19H,9H2,(H,17,20)(H,18,21)
InChIKeyLMLQCRNHFQDREN-UHFFFAOYSA-N
XLogP1.53
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.28
LogP ≤ 51.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-hydroxy-N'-[2-(3-hydroxyphenyl)acetyl]-2-(trifluoromethyl)benzohydrazide
CID 59422031
2-fluoro-N-[2-oxo-2-[2-(2-phenylacetyl)hydrazinyl]ethyl]benzamide
CID 24637562
N'-[3-(3-chlorophenyl)propanoyl]-2-fluorobenzohydrazide
CID 51277577
2-chloro-N'-[2-(3-hydroxyphenyl)acetyl]-4,5-dimethoxybenzohydrazide
CID 59421984
[2-[2-(2-fluorobenzoyl)hydrazinyl]-2-oxoethyl] 2,6-difluorobenzoate
CID 7725646
4-(chloromethyl)-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
CID 59422014
N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide
CID 149266850
2-fluoro-N'-[3-(methylsulfanylmethyl)benzoyl]benzohydrazide
CID 9274402
2-fluoro-N'-[2-(3-fluorophenoxy)acetyl]benzohydrazide
CID 2709557
N'-[2-(3-fluorophenyl)acetyl]benzohydrazide
CID 9414915
methyl 4-[[[2-(3-hydroxyphenyl)acetyl]amino]carbamoyl]benzoate
CID 59421998
N'-[2-(3-hydroxyphenyl)acetyl]-3,5-dinitrobenzohydrazide
CID 59421966

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide?
The IUPAC name of 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide (CID 59422019) is 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide.
What is the SMILES notation for 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide?
The canonical SMILES for 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide is O=C(Cc1cccc(O)c1)NNC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide?
The InChIKey is LMLQCRNHFQDREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O3/c16-13-7-2-1-6-12(13)15(21)18-17-14(20)9-10-4-3-5-11(19)8-10/h1-8,19H,9H2,(H,17,20)(H,18,21).
What are the key properties of 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide?
2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide has a molecular weight of 288.28 g/mol, XLogP of 1.53, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide is sourced from PubChem (CID 59422019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).