1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide

C13H16FN3O2 — CID 63978579

IUPAC1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1C(=O)c1ccc(F)nc1
InChIInChI=1S/C13H16FN3O2/c1-15-12(18)10-4-2-3-7-17(10)13(19)9-5-6-11(14)16-8-9/h5-6,8,10H,2-4,7H2,1H3,(H,15,18)
InChIKeyZGNKOCOCRNKRCI-UHFFFAOYSA-N
MW265.29 g/mol
LogP0.96
Rot. Bonds2

About 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide

1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide (PubChem CID 63978579) has the molecular formula C13H16FN3O2 and a molecular weight of 265.29 g/mol. Its IUPAC name is 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide
PubChem CID63978579
Molecular FormulaC13H16FN3O2
Molecular Weight265.29 g/mol
Exact Mass265.12
IUPAC Name1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1C(=O)c1ccc(F)nc1
InChIInChI=1S/C13H16FN3O2/c1-15-12(18)10-4-2-3-7-17(10)13(19)9-5-6-11(14)16-8-9/h5-6,8,10H,2-4,7H2,1H3,(H,15,18)
InChIKeyZGNKOCOCRNKRCI-UHFFFAOYSA-N
XLogP0.96
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-1-(6-fluoropyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 63979920
1-(6-fluoropyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 63972948
(6-fluoro-3-pyridinyl)-(2-iodopiperidin-1-yl)methanone
CID 68880844
1-(5,6-dichloropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide
CID 60749477
(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
CID 63978793
(2R)-1-[6-(methylcarbamoyl)pyridine-3-carbonyl]piperidine-2-carboxylic acid
CID 120537319
(2-cyclohexylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
CID 63979551
(2-ethylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
CID 63971232
1-(4-amino-3-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide
CID 62681861
N-methyl-1-[5-(methylamino)pyridine-3-carbonyl]pyrrolidine-2-carboxamide
CID 171851711
1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide
CID 63716587
(2R)-1-[4-(4-methoxypyrimidin-2-yl)benzoyl]-N-methylpiperidine-2-carboxamide
CID 126429824

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide?
The IUPAC name of 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide (CID 63978579) is 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide is CNC(=O)C1CCCCN1C(=O)c1ccc(F)nc1.
What is the InChIKey of 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide?
The InChIKey is ZGNKOCOCRNKRCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3O2/c1-15-12(18)10-4-2-3-7-17(10)13(19)9-5-6-11(14)16-8-9/h5-6,8,10H,2-4,7H2,1H3,(H,15,18).
What are the key properties of 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide?
1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide has a molecular weight of 265.29 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 63978579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).