N-hydroxy-8-oxo-8-pyridin-3-yloctanamide

C13H18N2O3 — CID 11128726

IUPACN-hydroxy-8-oxo-8-pyridin-3-yloctanamide
SMILESO=C(CCCCCCC(=O)c1cccnc1)NO
InChIInChI=1S/C13H18N2O3/c16-12(11-6-5-9-14-10-11)7-3-1-2-4-8-13(17)15-18/h5-6,9-10,18H,1-4,7-8H2,(H,15,17)
InChIKeyAAHQDWBMLVLXAC-UHFFFAOYSA-N
MW250.30 g/mol
LogP2.11
Rot. Bonds8

About N-hydroxy-8-oxo-8-pyridin-3-yloctanamide

N-hydroxy-8-oxo-8-pyridin-3-yloctanamide (PubChem CID 11128726) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-hydroxy-8-oxo-8-pyridin-3-yloctanamide.

Molecular Properties

Compound NameN-hydroxy-8-oxo-8-pyridin-3-yloctanamide
PubChem CID11128726
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-hydroxy-8-oxo-8-pyridin-3-yloctanamide
SMILESO=C(CCCCCCC(=O)c1cccnc1)NO
InChIInChI=1S/C13H18N2O3/c16-12(11-6-5-9-14-10-11)7-3-1-2-4-8-13(17)15-18/h5-6,9-10,18H,1-4,7-8H2,(H,15,17)
InChIKeyAAHQDWBMLVLXAC-UHFFFAOYSA-N
XLogP2.11
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-hydroxy-8-oxo-8-pyridin-3-yloctanamide?
The IUPAC name of N-hydroxy-8-oxo-8-pyridin-3-yloctanamide (CID 11128726) is N-hydroxy-8-oxo-8-pyridin-3-yloctanamide.
What is the SMILES notation for N-hydroxy-8-oxo-8-pyridin-3-yloctanamide?
The canonical SMILES for N-hydroxy-8-oxo-8-pyridin-3-yloctanamide is O=C(CCCCCCC(=O)c1cccnc1)NO.
What is the InChIKey of N-hydroxy-8-oxo-8-pyridin-3-yloctanamide?
The InChIKey is AAHQDWBMLVLXAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c16-12(11-6-5-9-14-10-11)7-3-1-2-4-8-13(17)15-18/h5-6,9-10,18H,1-4,7-8H2,(H,15,17).
What are the key properties of N-hydroxy-8-oxo-8-pyridin-3-yloctanamide?
N-hydroxy-8-oxo-8-pyridin-3-yloctanamide has a molecular weight of 250.30 g/mol, XLogP of 2.11, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-8-oxo-8-pyridin-3-yloctanamide is sourced from PubChem (CID 11128726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).