N-(6-fluoro-2-pyridinyl)octanamide

C13H19FN2O — CID 104820556

IUPACN-(6-fluoro-2-pyridinyl)octanamide
SMILESCCCCCCCC(=O)Nc1cccc(F)n1
InChIInChI=1S/C13H19FN2O/c1-2-3-4-5-6-10-13(17)16-12-9-7-8-11(14)15-12/h7-9H,2-6,10H2,1H3,(H,15,16,17)
InChIKeyIOLVISSZZAPJPZ-UHFFFAOYSA-N
MW238.31 g/mol
LogP3.52
Rot. Bonds7

About N-(6-fluoro-2-pyridinyl)octanamide

N-(6-fluoro-2-pyridinyl)octanamide (PubChem CID 104820556) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is N-(6-fluoro-2-pyridinyl)octanamide.

Molecular Properties

Compound NameN-(6-fluoro-2-pyridinyl)octanamide
PubChem CID104820556
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC NameN-(6-fluoro-2-pyridinyl)octanamide
SMILESCCCCCCCC(=O)Nc1cccc(F)n1
InChIInChI=1S/C13H19FN2O/c1-2-3-4-5-6-10-13(17)16-12-9-7-8-11(14)15-12/h7-9H,2-6,10H2,1H3,(H,15,16,17)
InChIKeyIOLVISSZZAPJPZ-UHFFFAOYSA-N
XLogP3.52
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(6-fluoro-2-pyridinyl)pentanamide
CID 104820722
N-[6-(tridecanoylamino)-2-pyridinyl]tridecanamide
CID 11038419
N-[6-(undecanoylamino)-2-pyridinyl]dodecanamide
CID 101442784
2-N-[6-(undecanoylamino)-2-pyridinyl]-6-N-[6-[[6-[[6-(undecanoylamino)-2-pyridinyl]carbamoyl]pyridine-2-carbonyl]amino]-2-pyridinyl]pyridine-2,6-dicarboxamide
CID 101146659
N-(6-fluoro-2-pyridinyl)-4-(propan-2-ylamino)butanamide
CID 116813202
4-amino-N-(6-fluoro-2-pyridinyl)-4-methylpentanamide
CID 116813180
N-(6-fluoro-2-pyridinyl)-3-phenylpropanamide
CID 104820903
N-[6-(hydroxymethyl)-2-pyridinyl]pentanamide
CID 82343736
N-(6-fluoro-2-pyridinyl)-3,3-dimethylbutanamide
CID 104820780
N-(6-fluoro-2-pyridinyl)-3-(2-methylphenyl)propanamide
CID 113456887
N-naphthalen-1-yldodecanamide
CID 588517
ethyl N-(6-fluoro-2-pyridinyl)carbamate
CID 45119575

Frequently Asked Questions

What is the IUPAC name of N-(6-fluoro-2-pyridinyl)octanamide?
The IUPAC name of N-(6-fluoro-2-pyridinyl)octanamide (CID 104820556) is N-(6-fluoro-2-pyridinyl)octanamide.
What is the SMILES notation for N-(6-fluoro-2-pyridinyl)octanamide?
The canonical SMILES for N-(6-fluoro-2-pyridinyl)octanamide is CCCCCCCC(=O)Nc1cccc(F)n1.
What is the InChIKey of N-(6-fluoro-2-pyridinyl)octanamide?
The InChIKey is IOLVISSZZAPJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-2-3-4-5-6-10-13(17)16-12-9-7-8-11(14)15-12/h7-9H,2-6,10H2,1H3,(H,15,16,17).
What are the key properties of N-(6-fluoro-2-pyridinyl)octanamide?
N-(6-fluoro-2-pyridinyl)octanamide has a molecular weight of 238.31 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-fluoro-2-pyridinyl)octanamide is sourced from PubChem (CID 104820556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).