1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide

C10H19FN2O2 — CID 155275587

IUPAC1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide
SMILESCC(C)(C)ONC(=O)C1CCN(F)CC1
InChIInChI=1S/C10H19FN2O2/c1-10(2,3)15-12-9(14)8-4-6-13(11)7-5-8/h8H,4-7H2,1-3H3,(H,12,14)
InChIKeyYSCOLFNKMBZIPQ-UHFFFAOYSA-N
MW218.27 g/mol
LogP1.43
Rot. Bonds2

About 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide

1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide (PubChem CID 155275587) has the molecular formula C10H19FN2O2 and a molecular weight of 218.27 g/mol. Its IUPAC name is 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide
PubChem CID155275587
Molecular FormulaC10H19FN2O2
Molecular Weight218.27 g/mol
Exact Mass218.14
IUPAC Name1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide
SMILESCC(C)(C)ONC(=O)C1CCN(F)CC1
InChIInChI=1S/C10H19FN2O2/c1-10(2,3)15-12-9(14)8-4-6-13(11)7-5-8/h8H,4-7H2,1-3H3,(H,12,14)
InChIKeyYSCOLFNKMBZIPQ-UHFFFAOYSA-N
XLogP1.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', '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 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide?
The IUPAC name of 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide (CID 155275587) is 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide.
What is the SMILES notation for 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide?
The canonical SMILES for 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide is CC(C)(C)ONC(=O)C1CCN(F)CC1.
What is the InChIKey of 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide?
The InChIKey is YSCOLFNKMBZIPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FN2O2/c1-10(2,3)15-12-9(14)8-4-6-13(11)7-5-8/h8H,4-7H2,1-3H3,(H,12,14).
What are the key properties of 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide?
1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide has a molecular weight of 218.27 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-[(2-methylpropan-2-yl)oxy]piperidine-4-carboxamide is sourced from PubChem (CID 155275587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).