N'-hydroxy-N-pyridin-2-yloctanediamide

C13H19N3O3 — CID 11747496

IUPACN'-hydroxy-N-pyridin-2-yloctanediamide
SMILESO=C(CCCCCCC(=O)Nc1ccccn1)NO
InChIInChI=1S/C13H19N3O3/c17-12(15-11-7-5-6-10-14-11)8-3-1-2-4-9-13(18)16-19/h5-7,10,19H,1-4,8-9H2,(H,16,18)(H,14,15,17)
InChIKeyUVYVSYPVDVIKCC-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.87
Rot. Bonds8

About N'-hydroxy-N-pyridin-2-yloctanediamide

N'-hydroxy-N-pyridin-2-yloctanediamide (PubChem CID 11747496) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N'-hydroxy-N-pyridin-2-yloctanediamide.

Molecular Properties

Compound NameN'-hydroxy-N-pyridin-2-yloctanediamide
PubChem CID11747496
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN'-hydroxy-N-pyridin-2-yloctanediamide
SMILESO=C(CCCCCCC(=O)Nc1ccccn1)NO
InChIInChI=1S/C13H19N3O3/c17-12(15-11-7-5-6-10-14-11)8-3-1-2-4-9-13(18)16-19/h5-7,10,19H,1-4,8-9H2,(H,16,18)(H,14,15,17)
InChIKeyUVYVSYPVDVIKCC-UHFFFAOYSA-N
XLogP1.87
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.87
H-Bond Donors ≤ 53
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-N-pyridin-2-yloctanediamide?
The IUPAC name of N'-hydroxy-N-pyridin-2-yloctanediamide (CID 11747496) is N'-hydroxy-N-pyridin-2-yloctanediamide.
What is the SMILES notation for N'-hydroxy-N-pyridin-2-yloctanediamide?
The canonical SMILES for N'-hydroxy-N-pyridin-2-yloctanediamide is O=C(CCCCCCC(=O)Nc1ccccn1)NO.
What is the InChIKey of N'-hydroxy-N-pyridin-2-yloctanediamide?
The InChIKey is UVYVSYPVDVIKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c17-12(15-11-7-5-6-10-14-11)8-3-1-2-4-9-13(18)16-19/h5-7,10,19H,1-4,8-9H2,(H,16,18)(H,14,15,17).
What are the key properties of N'-hydroxy-N-pyridin-2-yloctanediamide?
N'-hydroxy-N-pyridin-2-yloctanediamide has a molecular weight of 265.31 g/mol, XLogP of 1.87, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-N-pyridin-2-yloctanediamide is sourced from PubChem (CID 11747496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).