N-(4-fluorophenyl)-N'-hydroxyoctanediamide

C14H19FN2O3 — CID 24861442

IUPACN-(4-fluorophenyl)-N'-hydroxyoctanediamide
SMILESO=C(CCCCCCC(=O)Nc1ccc(F)cc1)NO
InChIInChI=1S/C14H19FN2O3/c15-11-7-9-12(10-8-11)16-13(18)5-3-1-2-4-6-14(19)17-20/h7-10,20H,1-6H2,(H,16,18)(H,17,19)
InChIKeyLVPDNYLMHLHWBD-UHFFFAOYSA-N
MW282.31 g/mol
LogP2.61
Rot. Bonds8

About N-(4-fluorophenyl)-N'-hydroxyoctanediamide

N-(4-fluorophenyl)-N'-hydroxyoctanediamide (PubChem CID 24861442) has the molecular formula C14H19FN2O3 and a molecular weight of 282.31 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N'-hydroxyoctanediamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N'-hydroxyoctanediamide
PubChem CID24861442
Molecular FormulaC14H19FN2O3
Molecular Weight282.31 g/mol
Exact Mass282.14
IUPAC NameN-(4-fluorophenyl)-N'-hydroxyoctanediamide
SMILESO=C(CCCCCCC(=O)Nc1ccc(F)cc1)NO
InChIInChI=1S/C14H19FN2O3/c15-11-7-9-12(10-8-11)16-13(18)5-3-1-2-4-6-14(19)17-20/h7-10,20H,1-6H2,(H,16,18)(H,17,19)
InChIKeyLVPDNYLMHLHWBD-UHFFFAOYSA-N
XLogP2.61
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N'-hydroxyoctanediamide?
The IUPAC name of N-(4-fluorophenyl)-N'-hydroxyoctanediamide (CID 24861442) is N-(4-fluorophenyl)-N'-hydroxyoctanediamide.
What is the SMILES notation for N-(4-fluorophenyl)-N'-hydroxyoctanediamide?
The canonical SMILES for N-(4-fluorophenyl)-N'-hydroxyoctanediamide is O=C(CCCCCCC(=O)Nc1ccc(F)cc1)NO.
What is the InChIKey of N-(4-fluorophenyl)-N'-hydroxyoctanediamide?
The InChIKey is LVPDNYLMHLHWBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O3/c15-11-7-9-12(10-8-11)16-13(18)5-3-1-2-4-6-14(19)17-20/h7-10,20H,1-6H2,(H,16,18)(H,17,19).
What are the key properties of N-(4-fluorophenyl)-N'-hydroxyoctanediamide?
N-(4-fluorophenyl)-N'-hydroxyoctanediamide has a molecular weight of 282.31 g/mol, XLogP of 2.61, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N'-hydroxyoctanediamide is sourced from PubChem (CID 24861442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).